EdisonScientific/glyph-datasets huggingface dataset:
SMILES: CCCc1ccc(N2C(=O)/C(=N\Nc3cccc(-c4cccc(C(=O)O)c4)c3O)c3cc(Cl)ccc32)cc1
SELFIES: [C][C][C][C][=C][C][=C][Branch2][Branch1][Ring2][N][C][=Branch1][C][=O][/C][=Branch2][Ring1][=N][=N][\N][C][=C][C][=C][C][Branch1][S][C][=C][C][=C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][=C][Ring1][=Branch2][=C][Ring1][#C][O][C][=C][C][Branch1][C][Cl][=C][C][=C][Ring1][#Branch1][Ring2][Ring1][=N][C][=C][Ring2][Ring2][Ring1]
InChI: InChI=1S/C30H24ClN3O4/c1-2-5-18-10-13-22(14-11-18)34-26-15-12-21(31)17-24(26)27(29(34)36)33-32-25-9-4-8-23(28(25)35)19-6-3-7-20(16-19)30(37)38/h3-4,6-17,32,35H,2,5H2,1H3,(H,37,38)/b33-27-
SMILES: CSc1ccc(N2C(=O)/C(=N\Nc3cccc(-c4cccc(C(=O)O)c4)c3O)c3ccccc32)cc1
SELFIES: [C][S][C][=C][C][=C][Branch2][Ring2][P][N][C][=Branch1][C][=O][/C][=Branch2][Ring1][=N][=N][\N][C][=C][C][=C][C][Branch1][S][C][=C][C][=C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][=C][Ring1][=Branch2][=C][Ring1][#C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring2][Ring1][N][C][=C][Ring2][Ring2][C]
InChI: InChI=1S/C28H21N3O4S/c1-36-20-14-12-19(13-15-20)31-24-11-3-2-8-22(24)25(27(31)33)30-29-23-10-5-9-21(26(23)32)17-6-4-7-18(16-17)28(34)35/h2-16,29,32H,1H3,(H,34,35)/b30-25-
SMILES: COCc1ccc(N2C(=O)/C(=N\Nc3cccc(-c4cccc(C(=O)O)c4)c3O)c3ccccc32)cc1
SELFIES: [C][O][C][C][=C][C][=C][Branch2][Ring2][P][N][C][=Branch1][C][=O][/C][=Branch2][Ring1][=N][=N][\N][C][=C][C][=C][C][Branch1][S][C][=C][C][=C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][=C][Ring1][=Branch2][=C][Ring1][#C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring2][Ring1][N][C][=C][Ring2][Ring2][C]
InChI: InChI=1S/C29H23N3O5/c1-37-17-18-12-14-21(15-13-18)32-25-11-3-2-8-23(25)26(28(32)34)31-30-24-10-5-9-22(27(24)33)19-6-4-7-20(16-19)29(35)36/h2-16,30,33H,17H2,1H3,(H,35,36)/b31-26-
SMILES: CC(O)(c1ccc(N2C(=O)/C(=N\Nc3cccc(-c4cccc(C(=O)O)c4)c3O)c3ccccc32)cc1)C(F)(F)F
SELFIES: [C][C][Branch1][C][O][Branch2][Branch1][=N][C][=C][C][=C][Branch2][Ring2][P][N][C][=Branch1][C][=O][/C][=Branch2][Ring1][=N][=N][\N][C][=C][C][=C][C][Branch1][S][C][=C][C][=C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][=C][Ring1][=Branch2][=C][Ring1][#C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring2][Ring1][N][C][=C][Ring2][Ring2][C][C][Branch1][C][F][Branch1][C][F][F]
InChI: InChI=1S/C30H22F3N3O5/c1-29(41,30(31,32)33)19-12-14-20(15-13-19)36-24-11-3-2-8-22(24)25(27(36)38)35-34-23-10-5-9-21(26(23)37)17-6-4-7-18(16-17)28(39)40/h2-16,34,37,41H,1H3,(H,39,40)/b35-25-
SMILES: Cc1ccc(N2C(=O)/C(=N\Nc3cccc(-c4cccc(C(=O)O)c4)c3O)c3cc(F)ccc32)cc1C(F)(F)F
SELFIES: [C][C][=C][C][=C][Branch2][Branch1][Ring2][N][C][=Branch1][C][=O][/C][=Branch2][Ring1][=N][=N][\N][C][=C][C][=C][C][Branch1][S][C][=C][C][=C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][=C][Ring1][=Branch2][=C][Ring1][#C][O][C][=C][C][Branch1][C][F][=C][C][=C][Ring1][#Branch1][Ring2][Ring1][=N][C][=C][Ring2][Ring2][Ring1][C][Branch1][C][F][Branch1][C][F][F]
InChI: InChI=1S/C29H19F4N3O4/c1-15-8-10-19(14-22(15)29(31,32)33)36-24-11-9-18(30)13-21(24)25(27(36)38)35-34-23-7-3-6-20(26(23)37)16-4-2-5-17(12-16)28(39)40/h2-14,34,37H,1H3,(H,39,40)/b35-25-
SMILES: COC(C)(c1ccc(N2C(=O)/C(=N\Nc3cccc(-c4cccc(C(=O)O)c4)c3O)c3ccccc32)cc1)C(F)(F)F
SELFIES: [C][O][C][Branch1][C][C][Branch2][Branch1][=N][C][=C][C][=C][Branch2][Ring2][P][N][C][=Branch1][C][=O][/C][=Branch2][Ring1][=N][=N][\N][C][=C][C][=C][C][Branch1][S][C][=C][C][=C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][=C][Ring1][=Branch2][=C][Ring1][#C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring2][Ring1][N][C][=C][Ring2][Ring2][C][C][Branch1][C][F][Branch1][C][F][F]
InChI: InChI=1S/C31H24F3N3O5/c1-30(42-2,31(32,33)34)20-13-15-21(16-14-20)37-25-12-4-3-9-23(25)26(28(37)39)36-35-24-11-6-10-22(27(24)38)18-7-5-8-19(17-18)29(40)41/h3-17,35,38H,1-2H3,(H,40,41)/b36-26-
SMILES: Cc1ccc(N2C(=O)/C(=N\Nc3cccc(-c4cccc(C(=O)O)c4)c3O)c3ccc(F)cc32)cc1C
SELFIES: [C][C][=C][C][=C][Branch2][Branch1][Ring2][N][C][=Branch1][C][=O][/C][=Branch2][Ring1][=N][=N][\N][C][=C][C][=C][C][Branch1][S][C][=C][C][=C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][=C][Ring1][=Branch2][=C][Ring1][#C][O][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][Ring2][Ring1][=N][C][=C][Ring2][Ring2][Ring1][C]
InChI: InChI=1S/C29H22FN3O4/c1-16-9-11-21(13-17(16)2)33-25-15-20(30)10-12-23(25)26(28(33)35)32-31-24-8-4-7-22(27(24)34)18-5-3-6-19(14-18)29(36)37/h3-15,31,34H,1-2H3,(H,36,37)/b32-26-
SMILES: CC(C)c1ccc(N2C(=O)/C(=N\Nc3cccc(-c4cccc(C(=O)O)c4)c3O)c3ccc(F)cc32)cc1
SELFIES: [C][C][Branch1][C][C][C][=C][C][=C][Branch2][Branch1][Ring2][N][C][=Branch1][C][=O][/C][=Branch2][Ring1][=N][=N][\N][C][=C][C][=C][C][Branch1][S][C][=C][C][=C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][=C][Ring1][=Branch2][=C][Ring1][#C][O][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][Ring2][Ring1][=N][C][=C][Ring2][Ring2][Ring1]
InChI: InChI=1S/C30H24FN3O4/c1-17(2)18-9-12-22(13-10-18)34-26-16-21(31)11-14-24(26)27(29(34)36)33-32-25-8-4-7-23(28(25)35)19-5-3-6-20(15-19)30(37)38/h3-17,32,35H,1-2H3,(H,37,38)/b33-27-
SMILES: Cc1ccc(N2C(=O)/C(=N\Nc3cccc(-c4cccc(C(=O)O)c4)c3O)c3cc(C(F)(F)F)ccc32)cc1C
SELFIES: [C][C][=C][C][=C][Branch2][Branch1][O][N][C][=Branch1][C][=O][/C][=Branch2][Ring1][=N][=N][\N][C][=C][C][=C][C][Branch1][S][C][=C][C][=C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][=C][Ring1][=Branch2][=C][Ring1][#C][O][C][=C][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=C][C][=C][Ring1][#Branch2][Ring2][Ring1][S][C][=C][Ring2][Ring2][=Branch1][C]
InChI: InChI=1S/C30H22F3N3O4/c1-16-9-11-21(13-17(16)2)36-25-12-10-20(30(31,32)33)15-23(25)26(28(36)38)35-34-24-8-4-7-22(27(24)37)18-5-3-6-19(14-18)29(39)40/h3-15,34,37H,1-2H3,(H,39,40)/b35-26-
SMILES: CCCc1ccc(N2C(=O)/C(=N\Nc3cccc(-c4cccc(C(=O)O)c4)c3O)c3ccc(F)cc32)cc1
SELFIES: [C][C][C][C][=C][C][=C][Branch2][Branch1][Ring2][N][C][=Branch1][C][=O][/C][=Branch2][Ring1][=N][=N][\N][C][=C][C][=C][C][Branch1][S][C][=C][C][=C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][=C][Ring1][=Branch2][=C][Ring1][#C][O][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][Ring2][Ring1][=N][C][=C][Ring2][Ring2][Ring1]
InChI: InChI=1S/C30H24FN3O4/c1-2-5-18-10-13-22(14-11-18)34-26-17-21(31)12-15-24(26)27(29(34)36)33-32-25-9-4-8-23(28(25)35)19-6-3-7-20(16-19)30(37)38/h3-4,6-17,32,35H,2,5H2,1H3,(H,37,38)/b33-27-
SMILES: CCCc1ccc(N2C(=O)/C(=N\Nc3cccc(-c4cccc(C(=O)O)c4)c3O)c3cc(C(F)(F)F)ccc32)cc1
SELFIES: [C][C][C][C][=C][C][=C][Branch2][Branch1][O][N][C][=Branch1][C][=O][/C][=Branch2][Ring1][=N][=N][\N][C][=C][C][=C][C][Branch1][S][C][=C][C][=C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][=C][Ring1][=Branch2][=C][Ring1][#C][O][C][=C][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=C][C][=C][Ring1][#Branch2][Ring2][Ring1][S][C][=C][Ring2][Ring2][=Branch1]
InChI: InChI=1S/C31H24F3N3O4/c1-2-5-18-10-13-22(14-11-18)37-26-15-12-21(31(32,33)34)17-24(26)27(29(37)39)36-35-25-9-4-8-23(28(25)38)19-6-3-7-20(16-19)30(40)41/h3-4,6-17,35,38H,2,5H2,1H3,(H,40,41)/b36-27-
SMILES: CC(C)c1ccc(N2C(=O)/C(=N\Nc3cccc(-c4cccc(C(=O)O)c4)c3O)c3c2ccc(F)c3F)cc1
SELFIES: [C][C][Branch1][C][C][C][=C][C][=C][Branch2][Branch1][Branch1][N][C][=Branch1][C][=O][/C][=Branch2][Ring1][=N][=N][\N][C][=C][C][=C][C][Branch1][S][C][=C][C][=C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][=C][Ring1][=Branch2][=C][Ring1][#C][O][C][=C][Ring2][Ring1][Branch2][C][=C][C][Branch1][C][F][=C][Ring1][#Branch1][F][C][=C][Ring2][Ring2][Ring2]
InChI: InChI=1S/C30H23F2N3O4/c1-16(2)17-9-11-20(12-10-17)35-24-14-13-22(31)26(32)25(24)27(29(35)37)34-33-23-8-4-7-21(28(23)36)18-5-3-6-19(15-18)30(38)39/h3-16,33,36H,1-2H3,(H,38,39)/b34-27-
SMILES: O=C(O)c1cccc(-c2cccc(N/N=C3\C(=O)N(C4CCNCC4)c4ccccc43)c2O)c1
SELFIES: [O][=C][Branch1][C][O][C][=C][C][=C][C][Branch2][Ring2][#Branch2][C][=C][C][=C][C][Branch2][Ring1][=N][N][/N][=C][\C][=Branch1][C][=O][N][Branch1][=Branch2][C][C][C][N][C][C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][S][=C][Ring2][Ring1][Branch2][O][=C][Ring2][Ring1][#C]
InChI: InChI=1S/C26H24N4O4/c31-24-19(16-5-3-6-17(15-16)26(33)34)8-4-9-21(24)28-29-23-20-7-1-2-10-22(20)30(25(23)32)18-11-13-27-14-12-18/h1-10,15,18,27-28,31H,11-14H2,(H,33,34)/b29-23-
SMILES: Cc1ccc(N2C(=O)/C(=N\Nc3cccc(-c4cccc(C(=O)O)c4)c3O)c3cc(F)ccc32)c(F)c1
SELFIES: [C][C][=C][C][=C][Branch2][Branch1][Ring2][N][C][=Branch1][C][=O][/C][=Branch2][Ring1][=N][=N][\N][C][=C][C][=C][C][Branch1][S][C][=C][C][=C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][=C][Ring1][=Branch2][=C][Ring1][#C][O][C][=C][C][Branch1][C][F][=C][C][=C][Ring1][#Branch1][Ring2][Ring1][=N][C][Branch1][C][F][=C][Ring2][Ring2][Ring2]
InChI: InChI=1S/C28H19F2N3O4/c1-15-8-10-24(21(30)12-15)33-23-11-9-18(29)14-20(23)25(27(33)35)32-31-22-7-3-6-19(26(22)34)16-4-2-5-17(13-16)28(36)37/h2-14,31,34H,1H3,(H,36,37)/b32-25-
SMILES: CN1C(=O)/C(=N\Nc2cccc(-c3cccc(C(=O)O)c3)c2O)c2ccccc21
SELFIES: [C][N][C][=Branch1][C][=O][/C][=Branch2][Ring1][=N][=N][\N][C][=C][C][=C][C][Branch1][S][C][=C][C][=C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][=C][Ring1][=Branch2][=C][Ring1][#C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring2][Ring1][N]
InChI: InChI=1S/C22H17N3O4/c1-25-18-11-3-2-8-16(18)19(21(25)27)24-23-17-10-5-9-15(20(17)26)13-6-4-7-14(12-13)22(28)29/h2-12,23,26H,1H3,(H,28,29)/b24-19-
SMILES: O=C(O)c1cccc(-c2cccc(N/N=C3\C(=O)N(C4CCCC4)c4ccccc43)c2O)c1
SELFIES: [O][=C][Branch1][C][O][C][=C][C][=C][C][Branch2][Ring2][=Branch2][C][=C][C][=C][C][Branch2][Ring1][N][N][/N][=C][\C][=Branch1][C][=O][N][Branch1][Branch2][C][C][C][C][C][Ring1][Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][#C][=C][Ring2][Ring1][#Branch1][O][=C][Ring2][Ring1][=C]
InChI: InChI=1S/C26H23N3O4/c30-24-19(16-7-5-8-17(15-16)26(32)33)12-6-13-21(24)27-28-23-20-11-3-4-14-22(20)29(25(23)31)18-9-1-2-10-18/h3-8,11-15,18,27,30H,1-2,9-10H2,(H,32,33)/b28-23-
SMILES: Cc1ccc2c(c1)N(c1ccc(C)c(C)c1)C(=O)/C2=N\Nc1cccc(-c2cccc(C(=O)O)c2)c1O
SELFIES: [C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][N][Branch1][#C][C][=C][C][=C][Branch1][C][C][C][Branch1][C][C][=C][Ring1][Branch2][C][=Branch1][C][=O][/C][Ring1][#C][=N][\N][C][=C][C][=C][C][Branch1][S][C][=C][C][=C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][=C][Ring1][=Branch2][=C][Ring1][#C][O]
InChI: InChI=1S/C30H25N3O4/c1-17-10-13-24-26(14-17)33(22-12-11-18(2)19(3)15-22)29(35)27(24)32-31-25-9-5-8-23(28(25)34)20-6-4-7-21(16-20)30(36)37/h4-16,31,34H,1-3H3,(H,36,37)/b32-27-
SMILES: O=C(O)c1cccc(-c2cccc(N/N=C3\C(=O)N(c4ccccc4)c4ccccc43)c2O)c1
SELFIES: [O][=C][Branch1][C][O][C][=C][C][=C][C][Branch2][Ring2][#Branch2][C][=C][C][=C][C][Branch2][Ring1][=N][N][/N][=C][\C][=Branch1][C][=O][N][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][S][=C][Ring2][Ring1][Branch2][O][=C][Ring2][Ring1][#C]
InChI: InChI=1S/C27H19N3O4/c31-25-20(17-8-6-9-18(16-17)27(33)34)13-7-14-22(25)28-29-24-21-12-4-5-15-23(21)30(26(24)32)19-10-2-1-3-11-19/h1-16,28,31H,(H,33,34)/b29-24-
SMILES: O=C(O)c1cccc(-c2cccc(N/N=C3\C(=O)N(c4ccccc4)c4cc(F)ccc43)c2O)c1
SELFIES: [O][=C][Branch1][C][O][C][=C][C][=C][C][Branch2][Ring2][=N][C][=C][C][=C][C][Branch2][Ring1][S][N][/N][=C][\C][=Branch1][C][=O][N][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][Branch1][C][F][=C][C][=C][Ring1][#Branch1][Ring1][P][=C][Ring2][Ring1][=Branch2][O][=C][Ring2][Ring1][S]
InChI: InChI=1S/C27H18FN3O4/c28-18-12-13-21-23(15-18)31(19-8-2-1-3-9-19)26(33)24(21)30-29-22-11-5-10-20(25(22)32)16-6-4-7-17(14-16)27(34)35/h1-15,29,32H,(H,34,35)/b30-24-
SMILES: Cc1ccc(N2C(=O)/C(=N\Nc3cccc(-c4cccc(C(=O)O)c4)c3O)c3ccc(C(C)C)cc32)cc1C
SELFIES: [C][C][=C][C][=C][Branch2][Branch1][Branch2][N][C][=Branch1][C][=O][/C][=Branch2][Ring1][=N][=N][\N][C][=C][C][=C][C][Branch1][S][C][=C][C][=C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][=C][Ring1][=Branch2][=C][Ring1][#C][O][C][=C][C][=C][Branch1][=Branch1][C][Branch1][C][C][C][C][=C][Ring1][=Branch2][Ring2][Ring1][#C][C][=C][Ring2][Ring2][Branch1][C]
InChI: InChI=1S/C32H29N3O4/c1-18(2)21-12-14-26-28(17-21)35(24-13-11-19(3)20(4)15-24)31(37)29(26)34-33-27-10-6-9-25(30(27)36)22-7-5-8-23(16-22)32(38)39/h5-18,33,36H,1-4H3,(H,38,39)/b34-29-
SMILES: Cc1ccc(N2C(=O)/C(=N\Nc3cccc(-c4cccc(C(=O)O)c4)c3O)c3c(C(C)C)cccc32)cc1C
SELFIES: [C][C][=C][C][=C][Branch2][Branch1][Branch2][N][C][=Branch1][C][=O][/C][=Branch2][Ring1][=N][=N][\N][C][=C][C][=C][C][Branch1][S][C][=C][C][=C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][=C][Ring1][=Branch2][=C][Ring1][#C][O][C][=C][Branch1][=Branch1][C][Branch1][C][C][C][C][=C][C][=C][Ring1][=Branch2][Ring2][Ring1][#C][C][=C][Ring2][Ring2][Branch1][C]
InChI: InChI=1S/C32H29N3O4/c1-18(2)24-10-7-13-27-28(24)29(31(37)35(27)23-15-14-19(3)20(4)16-23)34-33-26-12-6-11-25(30(26)36)21-8-5-9-22(17-21)32(38)39/h5-18,33,36H,1-4H3,(H,38,39)/b34-29-
SMILES: Cc1ccc(N2C(=O)/C(=N\Nc3cccc(-c4ccc(F)c(C(=O)O)c4)c3O)c3ccc(C(F)(F)F)cc32)cc1C
SELFIES: [C][C][=C][C][=C][Branch2][Branch1][#C][N][C][=Branch1][C][=O][/C][=Branch2][Ring1][P][=N][\N][C][=C][C][=C][C][Branch2][Ring1][Ring1][C][=C][C][=C][Branch1][C][F][C][Branch1][=Branch1][C][=Branch1][C][=O][O][=C][Ring1][#Branch2][=C][Ring1][S][O][C][=C][C][=C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][C][=C][Ring1][#Branch2][Ring2][Ring1][P][C][=C][Ring2][Ring2][#Branch1][C]
InChI: InChI=1S/C30H21F4N3O4/c1-15-6-9-19(12-16(15)2)37-25-14-18(30(32,33)34)8-10-21(25)26(28(37)39)36-35-24-5-3-4-20(27(24)38)17-7-11-23(31)22(13-17)29(40)41/h3-14,35,38H,1-2H3,(H,40,41)/b36-26-
SMILES: Cc1ccc(N2C(=O)/C(=N\Nc3cc(Cl)cc(-c4ccc(F)c(C(=O)O)c4)c3O)c3ccc(C(F)(F)F)cc32)cc1C
SELFIES: [C][C][=C][C][=C][Branch2][=Branch1][C][N][C][=Branch1][C][=O][/C][=Branch2][Ring2][Ring2][=N][\N][C][=C][C][Branch1][C][Cl][=C][C][Branch2][Ring1][Ring1][C][=C][C][=C][Branch1][C][F][C][Branch1][=Branch1][C][=Branch1][C][=O][O][=C][Ring1][#Branch2][=C][Ring1][P][O][C][=C][C][=C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][C][=C][Ring1][#Branch2][Ring2][Ring2][C][C][=C][Ring2][Ring2][Branch2][C]
InChI: InChI=1S/C30H20ClF4N3O4/c1-14-3-6-19(9-15(14)2)38-25-11-17(30(33,34)35)5-7-20(25)26(28(38)40)37-36-24-13-18(31)12-21(27(24)39)16-4-8-23(32)22(10-16)29(41)42/h3-13,36,39H,1-2H3,(H,41,42)/b37-26-
SMILES: Cc1ccc(N2C(=O)/C(=N\Nc3cccc(-c4cc(C(=O)O)ccc4F)c3O)c3ccc(C(F)(F)F)cc32)cc1C
SELFIES: [C][C][=C][C][=C][Branch2][Branch1][N][N][C][=Branch1][C][=O][/C][=Branch2][Ring1][=C][=N][\N][C][=C][C][=C][C][Branch1][P][C][=C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][=C][C][=C][Ring1][=Branch2][F][=C][Ring1][S][O][C][=C][C][=C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][C][=C][Ring1][#Branch2][Ring2][Ring1][P][C][=C][Ring2][Ring2][#Branch1][C]
InChI: InChI=1S/C30H21F4N3O4/c1-15-6-9-19(12-16(15)2)37-25-14-18(30(32,33)34)8-10-21(25)26(28(37)39)36-35-24-5-3-4-20(27(24)38)22-13-17(29(40)41)7-11-23(22)31/h3-14,35,38H,1-2H3,(H,40,41)/b36-26-
SMILES: Cc1ccc(N2C(=O)/C(=N\Nc3cccc(-c4cccc(C(=O)O)c4)c3O)c3c2ccc(F)c3F)cc1C
SELFIES: [C][C][=C][C][=C][Branch2][Branch1][Branch1][N][C][=Branch1][C][=O][/C][=Branch2][Ring1][=N][=N][\N][C][=C][C][=C][C][Branch1][S][C][=C][C][=C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][=C][Ring1][=Branch2][=C][Ring1][#C][O][C][=C][Ring2][Ring1][Branch2][C][=C][C][Branch1][C][F][=C][Ring1][#Branch1][F][C][=C][Ring2][Ring2][Ring2][C]
InChI: InChI=1S/C29H21F2N3O4/c1-15-9-10-19(13-16(15)2)34-23-12-11-21(30)25(31)24(23)26(28(34)36)33-32-22-8-4-7-20(27(22)35)17-5-3-6-18(14-17)29(37)38/h3-14,32,35H,1-2H3,(H,37,38)/b33-26-
SMILES: Cc1ccc(N2C(=O)/C(=N\Nc3cccc(-c4ccc(C(=O)O)c(C)c4)c3O)c3ccc(C(F)(F)F)cc32)cc1C
SELFIES: [C][C][=C][C][=C][Branch2][Branch1][#C][N][C][=Branch1][C][=O][/C][=Branch2][Ring1][P][=N][\N][C][=C][C][=C][C][Branch2][Ring1][Ring1][C][=C][C][=C][Branch1][=Branch1][C][=Branch1][C][=O][O][C][Branch1][C][C][=C][Ring1][#Branch2][=C][Ring1][S][O][C][=C][C][=C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][C][=C][Ring1][#Branch2][Ring2][Ring1][P][C][=C][Ring2][Ring2][#Branch1][C]
InChI: InChI=1S/C31H24F3N3O4/c1-16-7-10-21(14-17(16)2)37-26-15-20(31(32,33)34)9-12-24(26)27(29(37)39)36-35-25-6-4-5-23(28(25)38)19-8-11-22(30(40)41)18(3)13-19/h4-15,35,38H,1-3H3,(H,40,41)/b36-27-
SMILES: Cc1ccc(N2C(=O)/C(=N\Nc3cccc(-c4ccc(C(=O)O)cc4F)c3O)c3ccc(C(F)(F)F)cc32)cc1C
SELFIES: [C][C][=C][C][=C][Branch2][Branch1][N][N][C][=Branch1][C][=O][/C][=Branch2][Ring1][=C][=N][\N][C][=C][C][=C][C][Branch1][P][C][=C][C][=C][Branch1][=Branch1][C][=Branch1][C][=O][O][C][=C][Ring1][=Branch2][F][=C][Ring1][S][O][C][=C][C][=C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][C][=C][Ring1][#Branch2][Ring2][Ring1][P][C][=C][Ring2][Ring2][#Branch1][C]
InChI: InChI=1S/C30H21F4N3O4/c1-15-6-9-19(12-16(15)2)37-25-14-18(30(32,33)34)8-11-22(25)26(28(37)39)36-35-24-5-3-4-21(27(24)38)20-10-7-17(29(40)41)13-23(20)31/h3-14,35,38H,1-2H3,(H,40,41)/b36-26-
SMILES: Cc1ccc(N2C(=O)/C(=N\Nc3cccc(-c4ccc(F)c(C(=O)O)c4)c3O)c3c(F)cc(C(F)(F)F)cc32)cc1C
SELFIES: [C][C][=C][C][=C][Branch2][=Branch1][C][N][C][=Branch1][C][=O][/C][=Branch2][Ring1][P][=N][\N][C][=C][C][=C][C][Branch2][Ring1][Ring1][C][=C][C][=C][Branch1][C][F][C][Branch1][=Branch1][C][=Branch1][C][=O][O][=C][Ring1][#Branch2][=C][Ring1][S][O][C][=C][Branch1][C][F][C][=C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][C][=C][Ring1][O][Ring2][Ring2][C][C][=C][Ring2][Ring2][Branch2][C]
InChI: InChI=1S/C30H20F5N3O4/c1-14-6-8-18(10-15(14)2)38-24-13-17(30(33,34)35)12-22(32)25(24)26(28(38)40)37-36-23-5-3-4-19(27(23)39)16-7-9-21(31)20(11-16)29(41)42/h3-13,36,39H,1-2H3,(H,41,42)/b37-26-
SMILES: Cc1ccc(N2C(=O)/C(=N\Nc3cc(Cl)cc(-c4ccc(F)c(C(=O)O)c4)c3O)c3c(F)cc(C(F)(F)F)cc32)cc1C
SELFIES: [C][C][=C][C][=C][Branch2][=Branch1][Branch1][N][C][=Branch1][C][=O][/C][=Branch2][Ring2][Ring2][=N][\N][C][=C][C][Branch1][C][Cl][=C][C][Branch2][Ring1][Ring1][C][=C][C][=C][Branch1][C][F][C][Branch1][=Branch1][C][=Branch1][C][=O][O][=C][Ring1][#Branch2][=C][Ring1][P][O][C][=C][Branch1][C][F][C][=C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][C][=C][Ring1][O][Ring2][Ring2][Ring1][C][=C][Ring2][Ring2][=Branch2][C]
InChI: InChI=1S/C30H19ClF5N3O4/c1-13-3-5-18(7-14(13)2)39-24-10-16(30(34,35)36)9-22(33)25(24)26(28(39)41)38-37-23-12-17(31)11-19(27(23)40)15-4-6-21(32)20(8-15)29(42)43/h3-12,37,40H,1-2H3,(H,42,43)/b38-26-
SMILES: COC(=O)c1ccc2c(c1)N(c1cc(C)cc(C)c1)C(=O)/C2=N\Nc1cccc(-c2cccc(C(=O)O)c2)c1O
SELFIES: [C][O][C][=Branch1][C][=O][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][N][Branch1][#C][C][=C][C][Branch1][C][C][=C][C][Branch1][C][C][=C][Ring1][Branch2][C][=Branch1][C][=O][/C][Ring1][#C][=N][\N][C][=C][C][=C][C][Branch1][S][C][=C][C][=C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][=C][Ring1][=Branch2][=C][Ring1][#C][O]
InChI: InChI=1S/C31H25N3O6/c1-17-12-18(2)14-22(13-17)34-26-16-21(31(39)40-3)10-11-24(26)27(29(34)36)33-32-25-9-5-8-23(28(25)35)19-6-4-7-20(15-19)30(37)38/h4-16,32,35H,1-3H3,(H,37,38)/b33-27-
SMILES: COC(=O)c1ccc2c(c1)N(c1cc(C)cc(C)c1)C(=O)/C2=N\Nc1cccc(-c2ccc(F)c(C(=O)O)c2)c1O
SELFIES: [C][O][C][=Branch1][C][=O][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][N][Branch1][#C][C][=C][C][Branch1][C][C][=C][C][Branch1][C][C][=C][Ring1][Branch2][C][=Branch1][C][=O][/C][Ring1][#C][=N][\N][C][=C][C][=C][C][Branch2][Ring1][Ring1][C][=C][C][=C][Branch1][C][F][C][Branch1][=Branch1][C][=Branch1][C][=O][O][=C][Ring1][#Branch2][=C][Ring1][S][O]
InChI: InChI=1S/C31H24FN3O6/c1-16-11-17(2)13-20(12-16)35-26-15-19(31(40)41-3)7-9-22(26)27(29(35)37)34-33-25-6-4-5-21(28(25)36)18-8-10-24(32)23(14-18)30(38)39/h4-15,33,36H,1-3H3,(H,38,39)/b34-27-
SMILES: COC(=O)c1ccc2c(c1)N(c1ccc(C)c(C)c1)C(=O)/C2=N\Nc1cccc(-c2ccc(F)c(C(=O)O)c2)c1O
SELFIES: [C][O][C][=Branch1][C][=O][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][N][Branch1][#C][C][=C][C][=C][Branch1][C][C][C][Branch1][C][C][=C][Ring1][Branch2][C][=Branch1][C][=O][/C][Ring1][#C][=N][\N][C][=C][C][=C][C][Branch2][Ring1][Ring1][C][=C][C][=C][Branch1][C][F][C][Branch1][=Branch1][C][=Branch1][C][=O][O][=C][Ring1][#Branch2][=C][Ring1][S][O]
InChI: InChI=1S/C31H24FN3O6/c1-16-7-10-20(13-17(16)2)35-26-15-19(31(40)41-3)8-11-22(26)27(29(35)37)34-33-25-6-4-5-21(28(25)36)18-9-12-24(32)23(14-18)30(38)39/h4-15,33,36H,1-3H3,(H,38,39)/b34-27-
SMILES: COC(=O)c1ccc2c(c1)N(c1cc(C)cc(C)c1)C(=O)/C2=N\Nc1cc(Cl)cc(-c2ccc(F)c(C(=O)O)c2)c1O
SELFIES: [C][O][C][=Branch1][C][=O][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][N][Branch1][#C][C][=C][C][Branch1][C][C][=C][C][Branch1][C][C][=C][Ring1][Branch2][C][=Branch1][C][=O][/C][Ring1][#C][=N][\N][C][=C][C][Branch1][C][Cl][=C][C][Branch2][Ring1][Ring1][C][=C][C][=C][Branch1][C][F][C][Branch1][=Branch1][C][=Branch1][C][=O][O][=C][Ring1][#Branch2][=C][Ring1][P][O]
InChI: InChI=1S/C31H23ClFN3O6/c1-15-8-16(2)10-20(9-15)36-26-12-18(31(41)42-3)4-6-21(26)27(29(36)38)35-34-25-14-19(32)13-22(28(25)37)17-5-7-24(33)23(11-17)30(39)40/h4-14,34,37H,1-3H3,(H,39,40)/b35-27-
SMILES: N#Cc1sccc1N1C(=O)/C(=N\Nc2cccc(-c3cccc(C(=O)O)c3)c2O)c2ccccc21
SELFIES: [N][#C][C][S][C][=C][C][=Ring1][Branch1][N][C][=Branch1][C][=O][/C][=Branch2][Ring1][=N][=N][\N][C][=C][C][=C][C][Branch1][S][C][=C][C][=C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][=C][Ring1][=Branch2][=C][Ring1][#C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring2][Ring1][N]
InChI: InChI=1S/C26H16N4O4S/c27-14-22-21(11-12-35-22)30-20-10-2-1-7-18(20)23(25(30)32)29-28-19-9-4-8-17(24(19)31)15-5-3-6-16(13-15)26(33)34/h1-13,28,31H,(H,33,34)/b29-23-
SMILES: O=C(O)c1cccc(-c2cccc(N/N=C3\C(=O)N(c4ccsc4)c4ccccc43)c2O)c1
SELFIES: [O][=C][Branch1][C][O][C][=C][C][=C][C][Branch2][Ring2][=Branch2][C][=C][C][=C][C][Branch2][Ring1][N][N][/N][=C][\C][=Branch1][C][=O][N][Branch1][Branch2][C][C][=C][S][C][=Ring1][Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][#C][=C][Ring2][Ring1][#Branch1][O][=C][Ring2][Ring1][=C]
InChI: InChI=1S/C25H17N3O4S/c29-23-18(15-5-3-6-16(13-15)25(31)32)8-4-9-20(23)26-27-22-19-7-1-2-10-21(19)28(24(22)30)17-11-12-33-14-17/h1-14,26,29H,(H,31,32)/b27-22-
SMILES: COC(=O)c1ccc2c(c1)N(c1ccc(C)c(C)c1)C(=O)/C2=N\Nc1cccc(-c2cccc(C(=O)O)c2)c1O
SELFIES: [C][O][C][=Branch1][C][=O][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][N][Branch1][#C][C][=C][C][=C][Branch1][C][C][C][Branch1][C][C][=C][Ring1][Branch2][C][=Branch1][C][=O][/C][Ring1][#C][=N][\N][C][=C][C][=C][C][Branch1][S][C][=C][C][=C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][=C][Ring1][=Branch2][=C][Ring1][#C][O]
InChI: InChI=1S/C31H25N3O6/c1-17-10-12-22(14-18(17)2)34-26-16-21(31(39)40-3)11-13-24(26)27(29(34)36)33-32-25-9-5-8-23(28(25)35)19-6-4-7-20(15-19)30(37)38/h4-16,32,35H,1-3H3,(H,37,38)/b33-27-
SMILES: N#Cc1ccc2c(c1)N(c1ccc(Cl)c(C(F)(F)F)c1)C(=O)/C2=N\Nc1cccc(-c2cccc(C(=O)O)c2)c1O
SELFIES: [N][#C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][N][Branch2][Ring1][=Branch1][C][=C][C][=C][Branch1][C][Cl][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=C][Ring1][O][C][=Branch1][C][=O][/C][Ring2][Ring1][C][=N][\N][C][=C][C][=C][C][Branch1][S][C][=C][C][=C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][=C][Ring1][=Branch2][=C][Ring1][#C][O]
InChI: InChI=1S/C29H16ClF3N4O4/c30-22-10-8-18(13-21(22)29(31,32)33)37-24-11-15(14-34)7-9-20(24)25(27(37)39)36-35-23-6-2-5-19(26(23)38)16-3-1-4-17(12-16)28(40)41/h1-13,35,38H,(H,40,41)/b36-25-
SMILES: CC(C)c1ccc(N2C(=O)/C(=N\Nc3cc(Cl)cc(-c4ccc(F)c(C(=O)O)c4)c3O)c3ccc(C#N)cc32)cc1
SELFIES: [C][C][Branch1][C][C][C][=C][C][=C][Branch2][Branch1][N][N][C][=Branch1][C][=O][/C][=Branch2][Ring2][Ring2][=N][\N][C][=C][C][Branch1][C][Cl][=C][C][Branch2][Ring1][Ring1][C][=C][C][=C][Branch1][C][F][C][Branch1][=Branch1][C][=Branch1][C][=O][O][=C][Ring1][#Branch2][=C][Ring1][P][O][C][=C][C][=C][Branch1][Ring1][C][#N][C][=C][Ring1][Branch2][Ring2][Ring1][S][C][=C][Ring2][Ring2][=Branch1]
InChI: InChI=1S/C31H22ClFN4O4/c1-16(2)18-4-7-21(8-5-18)37-27-11-17(15-34)3-9-22(27)28(30(37)39)36-35-26-14-20(32)13-23(29(26)38)19-6-10-25(33)24(12-19)31(40)41/h3-14,16,35,38H,1-2H3,(H,40,41)/b36-28-
SMILES: CC(C)c1ccc(N2C(=O)/C(=N\Nc3cccc(-c4ccc(F)c(C(=O)O)c4)c3O)c3ccc(C#N)cc32)cc1
SELFIES: [C][C][Branch1][C][C][C][=C][C][=C][Branch2][Branch1][=Branch2][N][C][=Branch1][C][=O][/C][=Branch2][Ring1][P][=N][\N][C][=C][C][=C][C][Branch2][Ring1][Ring1][C][=C][C][=C][Branch1][C][F][C][Branch1][=Branch1][C][=Branch1][C][=O][O][=C][Ring1][#Branch2][=C][Ring1][S][O][C][=C][C][=C][Branch1][Ring1][C][#N][C][=C][Ring1][Branch2][Ring2][Ring1][#C][C][=C][Ring2][Ring2][Branch1]
InChI: InChI=1S/C31H23FN4O4/c1-17(2)19-7-10-21(11-8-19)36-27-14-18(16-33)6-12-23(27)28(30(36)38)35-34-26-5-3-4-22(29(26)37)20-9-13-25(32)24(15-20)31(39)40/h3-15,17,34,37H,1-2H3,(H,39,40)/b35-28-