EdisonScientific/glyph-datasets huggingface dataset:
SMILES: CC(C)c1onc(-c2c(Cl)cccc2Cl)c1COc1ccc(N(C)S(=O)(=O)c2ccc(C(=O)O)cc2)cc1
SELFIES: [C][C][Branch1][C][C][C][O][N][=C][Branch1][=N][C][=C][Branch1][C][Cl][C][=C][C][=C][Ring1][#Branch1][Cl][C][=Ring1][=N][C][O][C][=C][C][=C][Branch2][Ring1][O][N][Branch1][C][C][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][Branch1][=Branch1][C][=Branch1][C][=O][O][C][=C][Ring1][=Branch2][C][=C][Ring2][Ring1][Ring2]
InChI: InChI=1S/C27H24Cl2N2O6S/c1-16(2)26-21(25(30-37-26)24-22(28)5-4-6-23(24)29)15-36-19-11-9-18(10-12-19)31(3)38(34,35)20-13-7-17(8-14-20)27(32)33/h4-14,16H,15H2,1-3H3,(H,32,33)
SMILES: CCN(c1ccc(OCc2c(-c3c(Cl)cccc3Cl)noc2C(C)C)cc1Cl)S(=O)(=O)c1ccc(C(=O)O)cc1
SELFIES: [C][C][N][Branch2][Ring2][#Branch2][C][=C][C][=C][Branch2][Ring1][=N][O][C][C][C][Branch1][=N][C][=C][Branch1][C][Cl][C][=C][C][=C][Ring1][#Branch1][Cl][=N][O][C][=Ring1][=N][C][Branch1][C][C][C][C][=C][Ring2][Ring1][Branch2][Cl][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][Branch1][=Branch1][C][=Branch1][C][=O][O][C][=C][Ring1][=Branch2]
InChI: InChI=1S/C28H25Cl3N2O6S/c1-4-33(40(36,37)19-11-8-17(9-12-19)28(34)35)24-13-10-18(14-23(24)31)38-15-20-26(32-39-27(20)16(2)3)25-21(29)6-5-7-22(25)30/h5-14,16H,4,15H2,1-3H3,(H,34,35)
SMILES: CCN(c1ccc(OCc2c(-c3c(Cl)cccc3Cl)noc2C(C)C)cc1C)S(=O)(=O)c1ccc(C(=O)O)cc1
SELFIES: [C][C][N][Branch2][Ring2][#Branch2][C][=C][C][=C][Branch2][Ring1][=N][O][C][C][C][Branch1][=N][C][=C][Branch1][C][Cl][C][=C][C][=C][Ring1][#Branch1][Cl][=N][O][C][=Ring1][=N][C][Branch1][C][C][C][C][=C][Ring2][Ring1][Branch2][C][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][Branch1][=Branch1][C][=Branch1][C][=O][O][C][=C][Ring1][=Branch2]
InChI: InChI=1S/C29H28Cl2N2O6S/c1-5-33(40(36,37)21-12-9-19(10-13-21)29(34)35)25-14-11-20(15-18(25)4)38-16-22-27(32-39-28(22)17(2)3)26-23(30)7-6-8-24(26)31/h6-15,17H,5,16H2,1-4H3,(H,34,35)
SMILES: CCN(c1ccc(OCc2c(-c3c(Cl)cccc3Cl)noc2C(C)C)cc1)S(=O)(=O)c1ccc(C(=O)O)cc1
SELFIES: [C][C][N][Branch2][Ring2][=Branch2][C][=C][C][=C][Branch2][Ring1][=N][O][C][C][C][Branch1][=N][C][=C][Branch1][C][Cl][C][=C][C][=C][Ring1][#Branch1][Cl][=N][O][C][=Ring1][=N][C][Branch1][C][C][C][C][=C][Ring2][Ring1][Branch2][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][Branch1][=Branch1][C][=Branch1][C][=O][O][C][=C][Ring1][=Branch2]
InChI: InChI=1S/C28H26Cl2N2O6S/c1-4-32(39(35,36)21-14-8-18(9-15-21)28(33)34)19-10-12-20(13-11-19)37-16-22-26(31-38-27(22)17(2)3)25-23(29)6-5-7-24(25)30/h5-15,17H,4,16H2,1-3H3,(H,33,34)
SMILES: CC(C)c1onc(-c2ccccc2OC(F)(F)F)c1COc1ccc(NS(=O)(=O)c2cccc(C(=O)O)c2)c(Cl)c1
SELFIES: [C][C][Branch1][C][C][C][O][N][=C][Branch2][Ring1][C][C][=C][C][=C][C][=C][Ring1][=Branch1][O][C][Branch1][C][F][Branch1][C][F][F][C][=Ring1][S][C][O][C][=C][C][=C][Branch2][Ring1][Branch2][N][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][=C][Ring1][=Branch2][C][Branch1][C][Cl][=C][Ring2][Ring1][Ring2]
InChI: InChI=1S/C27H22ClF3N2O7S/c1-15(2)25-20(24(32-40-25)19-8-3-4-9-23(19)39-27(29,30)31)14-38-17-10-11-22(21(28)13-17)33-41(36,37)18-7-5-6-16(12-18)26(34)35/h3-13,15,33H,14H2,1-2H3,(H,34,35)
SMILES: Cc1cc(OCc2c(-c3ccccc3OC(F)(F)F)noc2C(C)C)ccc1NS(=O)(=O)c1cccc(C(=O)O)c1
SELFIES: [C][C][=C][C][Branch2][Ring2][Ring1][O][C][C][C][Branch2][Ring1][C][C][=C][C][=C][C][=C][Ring1][=Branch1][O][C][Branch1][C][F][Branch1][C][F][F][=N][O][C][=Ring1][S][C][Branch1][C][C][C][=C][C][=C][Ring2][Ring1][O][N][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][=C][Ring1][=Branch2]
InChI: InChI=1S/C28H25F3N2O7S/c1-16(2)26-22(25(32-40-26)21-9-4-5-10-24(21)39-28(29,30)31)15-38-19-11-12-23(17(3)13-19)33-41(36,37)20-8-6-7-18(14-20)27(34)35/h4-14,16,33H,15H2,1-3H3,(H,34,35)
SMILES: COC(=O)c1cccc(S(=O)(=O)N(C)c2ccc(OCc3c(-c4ccccc4OC(F)(F)F)noc3C(C)C)cc2Cl)c1
SELFIES: [C][O][C][=Branch1][C][=O][C][=C][C][=C][C][Branch2][Branch1][O][S][=Branch1][C][=O][=Branch1][C][=O][N][Branch1][C][C][C][=C][C][=C][Branch2][Ring2][Ring1][O][C][C][C][Branch2][Ring1][C][C][=C][C][=C][C][=C][Ring1][=Branch1][O][C][Branch1][C][F][Branch1][C][F][F][=N][O][C][=Ring1][S][C][Branch1][C][C][C][C][=C][Ring2][Ring1][O][Cl][=C][Ring2][Ring2][#Branch1]
InChI: InChI=1S/C29H26ClF3N2O7S/c1-17(2)27-22(26(34-42-27)21-10-5-6-11-25(21)41-29(31,32)33)16-40-19-12-13-24(23(30)15-19)35(3)43(37,38)20-9-7-8-18(14-20)28(36)39-4/h5-15,17H,16H2,1-4H3
SMILES: COC(=O)c1cccc(S(=O)(=O)N(C)c2ccc(OCc3c(-c4ccccc4OC(F)(F)F)noc3C(C)C)cc2C)c1
SELFIES: [C][O][C][=Branch1][C][=O][C][=C][C][=C][C][Branch2][Branch1][O][S][=Branch1][C][=O][=Branch1][C][=O][N][Branch1][C][C][C][=C][C][=C][Branch2][Ring2][Ring1][O][C][C][C][Branch2][Ring1][C][C][=C][C][=C][C][=C][Ring1][=Branch1][O][C][Branch1][C][F][Branch1][C][F][F][=N][O][C][=Ring1][S][C][Branch1][C][C][C][C][=C][Ring2][Ring1][O][C][=C][Ring2][Ring2][#Branch1]
InChI: InChI=1S/C30H29F3N2O7S/c1-18(2)28-24(27(34-42-28)23-11-6-7-12-26(23)41-30(31,32)33)17-40-21-13-14-25(19(3)15-21)35(4)43(37,38)22-10-8-9-20(16-22)29(36)39-5/h6-16,18H,17H2,1-5H3
SMILES: Cc1cc(OCc2c(-c3ccccc3OC(F)(F)F)noc2C(C)C)ccc1N(C)S(=O)(=O)c1cccc(C(=O)O)c1
SELFIES: [C][C][=C][C][Branch2][Ring2][Ring1][O][C][C][C][Branch2][Ring1][C][C][=C][C][=C][C][=C][Ring1][=Branch1][O][C][Branch1][C][F][Branch1][C][F][F][=N][O][C][=Ring1][S][C][Branch1][C][C][C][=C][C][=C][Ring2][Ring1][O][N][Branch1][C][C][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][=C][Ring1][=Branch2]
InChI: InChI=1S/C29H27F3N2O7S/c1-17(2)27-23(26(33-41-27)22-10-5-6-11-25(22)40-29(30,31)32)16-39-20-12-13-24(18(3)14-20)34(4)42(37,38)21-9-7-8-19(15-21)28(35)36/h5-15,17H,16H2,1-4H3,(H,35,36)
SMILES: CCc1onc(Cc2c(Cl)cccc2Cl)c1COc1ccc(N(C)S(=O)(=O)c2cccc(C(=O)O)c2)c(C)c1
SELFIES: [C][C][C][O][N][=C][Branch1][=C][C][C][=C][Branch1][C][Cl][C][=C][C][=C][Ring1][#Branch1][Cl][C][=Ring1][=C][C][O][C][=C][C][=C][Branch2][Ring1][O][N][Branch1][C][C][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][=C][Ring1][=Branch2][C][Branch1][C][C][=C][Ring2][Ring1][Branch1]
InChI: InChI=1S/C28H26Cl2N2O6S/c1-4-27-22(25(31-38-27)15-21-23(29)9-6-10-24(21)30)16-37-19-11-12-26(17(2)13-19)32(3)39(35,36)20-8-5-7-18(14-20)28(33)34/h5-14H,4,15-16H2,1-3H3,(H,33,34)
SMILES: COC(=O)c1ccc(OCc2ccc(OCc3c(-c4c(Cl)cccc4Cl)noc3C(C)C)cc2Cl)cc1
SELFIES: [C][O][C][=Branch1][C][=O][C][=C][C][=C][Branch2][Ring2][N][O][C][C][=C][C][=C][Branch2][Ring1][=N][O][C][C][C][Branch1][=N][C][=C][Branch1][C][Cl][C][=C][C][=C][Ring1][#Branch1][Cl][=N][O][C][=Ring1][=N][C][Branch1][C][C][C][C][=C][Ring2][Ring1][Branch2][Cl][C][=C][Ring2][Ring1][P]
InChI: InChI=1S/C28H24Cl3NO5/c1-16(2)27-21(26(32-37-27)25-22(29)5-4-6-23(25)30)15-36-20-12-9-18(24(31)13-20)14-35-19-10-7-17(8-11-19)28(33)34-3/h4-13,16H,14-15H2,1-3H3
SMILES: COC(=O)c1cccc(OCc2ccc(OCc3c(-c4c(Cl)cccc4Cl)noc3C(C)C)cc2Cl)c1
SELFIES: [C][O][C][=Branch1][C][=O][C][=C][C][=C][C][Branch2][Ring2][N][O][C][C][=C][C][=C][Branch2][Ring1][=N][O][C][C][C][Branch1][=N][C][=C][Branch1][C][Cl][C][=C][C][=C][Ring1][#Branch1][Cl][=N][O][C][=Ring1][=N][C][Branch1][C][C][C][C][=C][Ring2][Ring1][Branch2][Cl][=C][Ring2][Ring1][P]
InChI: InChI=1S/C28H24Cl3NO5/c1-16(2)27-21(26(32-37-27)25-22(29)8-5-9-23(25)30)15-36-20-11-10-18(24(31)13-20)14-35-19-7-4-6-17(12-19)28(33)34-3/h4-13,16H,14-15H2,1-3H3
SMILES: CC(C)c1onc(-c2c(Cl)cccc2Cl)c1COc1ccc(COc2cccc(C(=O)O)c2)c(Cl)c1
SELFIES: [C][C][Branch1][C][C][C][O][N][=C][Branch1][=N][C][=C][Branch1][C][Cl][C][=C][C][=C][Ring1][#Branch1][Cl][C][=Ring1][=N][C][O][C][=C][C][=C][Branch2][Ring1][C][C][O][C][=C][C][=C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][=C][Ring1][=Branch2][C][Branch1][C][Cl][=C][Ring2][Ring1][C]
InChI: InChI=1S/C27H22Cl3NO5/c1-15(2)26-20(25(31-36-26)24-21(28)7-4-8-22(24)29)14-35-19-10-9-17(23(30)12-19)13-34-18-6-3-5-16(11-18)27(32)33/h3-12,15H,13-14H2,1-2H3,(H,32,33)
SMILES: CC(C)c1onc(-c2c(Cl)cccc2Cl)c1COc1ccc(CSc2cccc(C(=O)O)c2)c(Cl)c1
SELFIES: [C][C][Branch1][C][C][C][O][N][=C][Branch1][=N][C][=C][Branch1][C][Cl][C][=C][C][=C][Ring1][#Branch1][Cl][C][=Ring1][=N][C][O][C][=C][C][=C][Branch2][Ring1][C][C][S][C][=C][C][=C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][=C][Ring1][=Branch2][C][Branch1][C][Cl][=C][Ring2][Ring1][C]
InChI: InChI=1S/C27H22Cl3NO4S/c1-15(2)26-20(25(31-35-26)24-21(28)7-4-8-22(24)29)13-34-18-10-9-17(23(30)12-18)14-36-19-6-3-5-16(11-19)27(32)33/h3-12,15H,13-14H2,1-2H3,(H,32,33)
SMILES: Cc1cc(OCc2c(-c3c(Cl)cccc3Cl)noc2C(C)C)ccc1COc1cccc(C(=O)O)c1
SELFIES: [C][C][=C][C][Branch2][Ring1][=N][O][C][C][C][Branch1][=N][C][=C][Branch1][C][Cl][C][=C][C][=C][Ring1][#Branch1][Cl][=N][O][C][=Ring1][=N][C][Branch1][C][C][C][=C][C][=C][Ring2][Ring1][Branch2][C][O][C][=C][C][=C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][=C][Ring1][=Branch2]
InChI: InChI=1S/C28H25Cl2NO5/c1-16(2)27-22(26(31-36-27)25-23(29)8-5-9-24(25)30)15-35-21-11-10-19(17(3)12-21)14-34-20-7-4-6-18(13-20)28(32)33/h4-13,16H,14-15H2,1-3H3,(H,32,33)
SMILES: Cc1cc(OCc2c(-c3c(Cl)cccc3Cl)noc2C(C)C)ccc1CSc1cccc(C(=O)O)c1
SELFIES: [C][C][=C][C][Branch2][Ring1][=N][O][C][C][C][Branch1][=N][C][=C][Branch1][C][Cl][C][=C][C][=C][Ring1][#Branch1][Cl][=N][O][C][=Ring1][=N][C][Branch1][C][C][C][=C][C][=C][Ring2][Ring1][Branch2][C][S][C][=C][C][=C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][=C][Ring1][=Branch2]
InChI: InChI=1S/C28H25Cl2NO4S/c1-16(2)27-22(26(31-35-27)25-23(29)8-5-9-24(25)30)14-34-20-11-10-19(17(3)12-20)15-36-21-7-4-6-18(13-21)28(32)33/h4-13,16H,14-15H2,1-3H3,(H,32,33)
SMILES: CC(C)c1onc(-c2c(Cl)cccc2Cl)c1COc1ccc(COc2ccc(C(=O)O)cc2)c(Cl)c1
SELFIES: [C][C][Branch1][C][C][C][O][N][=C][Branch1][=N][C][=C][Branch1][C][Cl][C][=C][C][=C][Ring1][#Branch1][Cl][C][=Ring1][=N][C][O][C][=C][C][=C][Branch2][Ring1][C][C][O][C][=C][C][=C][Branch1][=Branch1][C][=Branch1][C][=O][O][C][=C][Ring1][=Branch2][C][Branch1][C][Cl][=C][Ring2][Ring1][C]
InChI: InChI=1S/C27H22Cl3NO5/c1-15(2)26-20(25(31-36-26)24-21(28)4-3-5-22(24)29)14-35-19-11-8-17(23(30)12-19)13-34-18-9-6-16(7-10-18)27(32)33/h3-12,15H,13-14H2,1-2H3,(H,32,33)
SMILES: CC(C)c1onc(-c2c(Cl)cccc2Cl)c1COc1ccc(CSc2ccc(C(=O)O)cc2)c(Cl)c1
SELFIES: [C][C][Branch1][C][C][C][O][N][=C][Branch1][=N][C][=C][Branch1][C][Cl][C][=C][C][=C][Ring1][#Branch1][Cl][C][=Ring1][=N][C][O][C][=C][C][=C][Branch2][Ring1][C][C][S][C][=C][C][=C][Branch1][=Branch1][C][=Branch1][C][=O][O][C][=C][Ring1][=Branch2][C][Branch1][C][Cl][=C][Ring2][Ring1][C]
InChI: InChI=1S/C27H22Cl3NO4S/c1-15(2)26-20(25(31-35-26)24-21(28)4-3-5-22(24)29)13-34-18-9-6-17(23(30)12-18)14-36-19-10-7-16(8-11-19)27(32)33/h3-12,15H,13-14H2,1-2H3,(H,32,33)
SMILES: COC(=O)c1cccc(OCc2ccc(OCc3c(-c4ccccc4OC(F)(F)F)noc3C(C)C)cc2Cl)c1
SELFIES: [C][O][C][=Branch1][C][=O][C][=C][C][=C][C][Branch2][Branch1][C][O][C][C][=C][C][=C][Branch2][Ring2][Ring1][O][C][C][C][Branch2][Ring1][C][C][=C][C][=C][C][=C][Ring1][=Branch1][O][C][Branch1][C][F][Branch1][C][F][F][=N][O][C][=Ring1][S][C][Branch1][C][C][C][C][=C][Ring2][Ring1][O][Cl][=C][Ring2][Ring2][Ring2]
InChI: InChI=1S/C29H25ClF3NO6/c1-17(2)27-23(26(34-40-27)22-9-4-5-10-25(22)39-29(31,32)33)16-38-21-12-11-19(24(30)14-21)15-37-20-8-6-7-18(13-20)28(35)36-3/h4-14,17H,15-16H2,1-3H3
SMILES: COC(=O)c1cccc(OCc2ccc(OCc3c(-c4ccccc4OC(F)(F)F)noc3C(C)C)cc2C)c1
SELFIES: [C][O][C][=Branch1][C][=O][C][=C][C][=C][C][Branch2][Branch1][C][O][C][C][=C][C][=C][Branch2][Ring2][Ring1][O][C][C][C][Branch2][Ring1][C][C][=C][C][=C][C][=C][Ring1][=Branch1][O][C][Branch1][C][F][Branch1][C][F][F][=N][O][C][=Ring1][S][C][Branch1][C][C][C][C][=C][Ring2][Ring1][O][C][=C][Ring2][Ring2][Ring2]
InChI: InChI=1S/C30H28F3NO6/c1-18(2)28-25(27(34-40-28)24-10-5-6-11-26(24)39-30(31,32)33)17-38-23-13-12-21(19(3)14-23)16-37-22-9-7-8-20(15-22)29(35)36-4/h5-15,18H,16-17H2,1-4H3
SMILES: CC(C)c1onc(-c2ccccc2OC(F)(F)F)c1COc1ccc(COc2cccc(C(=O)O)c2)c(Cl)c1
SELFIES: [C][C][Branch1][C][C][C][O][N][=C][Branch2][Ring1][C][C][=C][C][=C][C][=C][Ring1][=Branch1][O][C][Branch1][C][F][Branch1][C][F][F][C][=Ring1][S][C][O][C][=C][C][=C][Branch2][Ring1][C][C][O][C][=C][C][=C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][=C][Ring1][=Branch2][C][Branch1][C][Cl][=C][Ring2][Ring1][C]
InChI: InChI=1S/C28H23ClF3NO6/c1-16(2)26-22(25(33-39-26)21-8-3-4-9-24(21)38-28(30,31)32)15-37-20-11-10-18(23(29)13-20)14-36-19-7-5-6-17(12-19)27(34)35/h3-13,16H,14-15H2,1-2H3,(H,34,35)
SMILES: Cc1cc(OCc2c(-c3ccccc3OC(F)(F)F)noc2C(C)C)ccc1COc1cccc(C(=O)O)c1
SELFIES: [C][C][=C][C][Branch2][Ring2][Ring1][O][C][C][C][Branch2][Ring1][C][C][=C][C][=C][C][=C][Ring1][=Branch1][O][C][Branch1][C][F][Branch1][C][F][F][=N][O][C][=Ring1][S][C][Branch1][C][C][C][=C][C][=C][Ring2][Ring1][O][C][O][C][=C][C][=C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][=C][Ring1][=Branch2]
InChI: InChI=1S/C29H26F3NO6/c1-17(2)27-24(26(33-39-27)23-9-4-5-10-25(23)38-29(30,31)32)16-37-22-12-11-20(18(3)13-22)15-36-21-8-6-7-19(14-21)28(34)35/h4-14,17H,15-16H2,1-3H3,(H,34,35)
SMILES: CCc1onc(Cc2c(Cl)cccc2Cl)c1COc1ccc(COc2cccc(C(=O)O)c2)c(Cl)c1
SELFIES: [C][C][C][O][N][=C][Branch1][=C][C][C][=C][Branch1][C][Cl][C][=C][C][=C][Ring1][#Branch1][Cl][C][=Ring1][=C][C][O][C][=C][C][=C][Branch2][Ring1][C][C][O][C][=C][C][=C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][=C][Ring1][=Branch2][C][Branch1][C][Cl][=C][Ring2][Ring1][C]
InChI: InChI=1S/C27H22Cl3NO5/c1-2-26-21(25(31-36-26)13-20-22(28)7-4-8-23(20)29)15-35-19-10-9-17(24(30)12-19)14-34-18-6-3-5-16(11-18)27(32)33/h3-12H,2,13-15H2,1H3,(H,32,33)
SMILES: COC(=O)c1cccc(SCc2ccc(OCc3c(-c4ccccc4OC(F)(F)F)noc3C(C)C)cc2Cl)c1
SELFIES: [C][O][C][=Branch1][C][=O][C][=C][C][=C][C][Branch2][Branch1][C][S][C][C][=C][C][=C][Branch2][Ring2][Ring1][O][C][C][C][Branch2][Ring1][C][C][=C][C][=C][C][=C][Ring1][=Branch1][O][C][Branch1][C][F][Branch1][C][F][F][=N][O][C][=Ring1][S][C][Branch1][C][C][C][C][=C][Ring2][Ring1][O][Cl][=C][Ring2][Ring2][Ring2]
InChI: InChI=1S/C29H25ClF3NO5S/c1-17(2)27-23(26(34-39-27)22-9-4-5-10-25(22)38-29(31,32)33)15-37-20-12-11-19(24(30)14-20)16-40-21-8-6-7-18(13-21)28(35)36-3/h4-14,17H,15-16H2,1-3H3
SMILES: COC(=O)c1cccc(SCc2ccc(OCc3c(-c4ccccc4OC(F)(F)F)noc3C(C)C)cc2C)c1
SELFIES: [C][O][C][=Branch1][C][=O][C][=C][C][=C][C][Branch2][Branch1][C][S][C][C][=C][C][=C][Branch2][Ring2][Ring1][O][C][C][C][Branch2][Ring1][C][C][=C][C][=C][C][=C][Ring1][=Branch1][O][C][Branch1][C][F][Branch1][C][F][F][=N][O][C][=Ring1][S][C][Branch1][C][C][C][C][=C][Ring2][Ring1][O][C][=C][Ring2][Ring2][Ring2]
InChI: InChI=1S/C30H28F3NO5S/c1-18(2)28-25(27(34-39-28)24-10-5-6-11-26(24)38-30(31,32)33)16-37-22-13-12-21(19(3)14-22)17-40-23-9-7-8-20(15-23)29(35)36-4/h5-15,18H,16-17H2,1-4H3
SMILES: CC(C)c1onc(-c2ccccc2OC(F)(F)F)c1COc1ccc(CSc2cccc(C(=O)O)c2)c(Cl)c1
SELFIES: [C][C][Branch1][C][C][C][O][N][=C][Branch2][Ring1][C][C][=C][C][=C][C][=C][Ring1][=Branch1][O][C][Branch1][C][F][Branch1][C][F][F][C][=Ring1][S][C][O][C][=C][C][=C][Branch2][Ring1][C][C][S][C][=C][C][=C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][=C][Ring1][=Branch2][C][Branch1][C][Cl][=C][Ring2][Ring1][C]
InChI: InChI=1S/C28H23ClF3NO5S/c1-16(2)26-22(25(33-38-26)21-8-3-4-9-24(21)37-28(30,31)32)14-36-19-11-10-18(23(29)13-19)15-39-20-7-5-6-17(12-20)27(34)35/h3-13,16H,14-15H2,1-2H3,(H,34,35)
SMILES: Cc1cc(OCc2c(-c3ccccc3OC(F)(F)F)noc2C(C)C)ccc1CSc1cccc(C(=O)O)c1
SELFIES: [C][C][=C][C][Branch2][Ring2][Ring1][O][C][C][C][Branch2][Ring1][C][C][=C][C][=C][C][=C][Ring1][=Branch1][O][C][Branch1][C][F][Branch1][C][F][F][=N][O][C][=Ring1][S][C][Branch1][C][C][C][=C][C][=C][Ring2][Ring1][O][C][S][C][=C][C][=C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][=C][Ring1][=Branch2]
InChI: InChI=1S/C29H26F3NO5S/c1-17(2)27-24(26(33-38-27)23-9-4-5-10-25(23)37-29(30,31)32)15-36-21-12-11-20(18(3)13-21)16-39-22-8-6-7-19(14-22)28(34)35/h4-14,17H,15-16H2,1-3H3,(H,34,35)
SMILES: COC(=O)c1cccc(N(C)Cc2ccc(OCc3c(-c4c(Cl)cccc4Cl)noc3C(C)C)cc2Cl)c1
SELFIES: [C][O][C][=Branch1][C][=O][C][=C][C][=C][C][Branch2][Ring2][#C][N][Branch1][C][C][C][C][=C][C][=C][Branch2][Ring1][=N][O][C][C][C][Branch1][=N][C][=C][Branch1][C][Cl][C][=C][C][=C][Ring1][#Branch1][Cl][=N][O][C][=Ring1][=N][C][Branch1][C][C][C][C][=C][Ring2][Ring1][Branch2][Cl][=C][Ring2][Ring2][C]
InChI: InChI=1S/C29H27Cl3N2O4/c1-17(2)28-22(27(33-38-28)26-23(30)9-6-10-24(26)31)16-37-21-12-11-19(25(32)14-21)15-34(3)20-8-5-7-18(13-20)29(35)36-4/h5-14,17H,15-16H2,1-4H3
SMILES: CC(C)c1onc(-c2c(Cl)cccc2Cl)c1COc1ccc(CN(C)c2cccc(C(=O)O)c2)c(Cl)c1
SELFIES: [C][C][Branch1][C][C][C][O][N][=C][Branch1][=N][C][=C][Branch1][C][Cl][C][=C][C][=C][Ring1][#Branch1][Cl][C][=Ring1][=N][C][O][C][=C][C][=C][Branch2][Ring1][Branch1][C][N][Branch1][C][C][C][=C][C][=C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][=C][Ring1][=Branch2][C][Branch1][C][Cl][=C][Ring2][Ring1][Ring1]
InChI: InChI=1S/C28H25Cl3N2O4/c1-16(2)27-21(26(32-37-27)25-22(29)8-5-9-23(25)30)15-36-20-11-10-18(24(31)13-20)14-33(3)19-7-4-6-17(12-19)28(34)35/h4-13,16H,14-15H2,1-3H3,(H,34,35)
SMILES: CC(C)c1onc(-c2c(Cl)cccc2Cl)c1COc1ccc(CNc2cccc(C(=O)O)c2)c(Cl)c1
SELFIES: [C][C][Branch1][C][C][C][O][N][=C][Branch1][=N][C][=C][Branch1][C][Cl][C][=C][C][=C][Ring1][#Branch1][Cl][C][=Ring1][=N][C][O][C][=C][C][=C][Branch2][Ring1][C][C][N][C][=C][C][=C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][=C][Ring1][=Branch2][C][Branch1][C][Cl][=C][Ring2][Ring1][C]
InChI: InChI=1S/C27H23Cl3N2O4/c1-15(2)26-20(25(32-36-26)24-21(28)7-4-8-22(24)29)14-35-19-10-9-17(23(30)12-19)13-31-18-6-3-5-16(11-18)27(33)34/h3-12,15,31H,13-14H2,1-2H3,(H,33,34)
SMILES: CCOC(=O)c1cccc(NCc2ccc(OCc3c(-c4ccccc4OC(F)(F)F)noc3C(C)C)cc2Cl)c1
SELFIES: [C][C][O][C][=Branch1][C][=O][C][=C][C][=C][C][Branch2][Branch1][C][N][C][C][=C][C][=C][Branch2][Ring2][Ring1][O][C][C][C][Branch2][Ring1][C][C][=C][C][=C][C][=C][Ring1][=Branch1][O][C][Branch1][C][F][Branch1][C][F][F][=N][O][C][=Ring1][S][C][Branch1][C][C][C][C][=C][Ring2][Ring1][O][Cl][=C][Ring2][Ring2][Ring2]
InChI: InChI=1S/C30H28ClF3N2O5/c1-4-38-29(37)19-8-7-9-21(14-19)35-16-20-12-13-22(15-25(20)31)39-17-24-27(36-41-28(24)18(2)3)23-10-5-6-11-26(23)40-30(32,33)34/h5-15,18,35H,4,16-17H2,1-3H3
SMILES: CC(C)c1onc(-c2ccccc2OC(F)(F)F)c1COc1ccc(CNc2cccc(C(=O)O)c2)c(Cl)c1
SELFIES: [C][C][Branch1][C][C][C][O][N][=C][Branch2][Ring1][C][C][=C][C][=C][C][=C][Ring1][=Branch1][O][C][Branch1][C][F][Branch1][C][F][F][C][=Ring1][S][C][O][C][=C][C][=C][Branch2][Ring1][C][C][N][C][=C][C][=C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][=C][Ring1][=Branch2][C][Branch1][C][Cl][=C][Ring2][Ring1][C]
InChI: InChI=1S/C28H24ClF3N2O5/c1-16(2)26-22(25(34-39-26)21-8-3-4-9-24(21)38-28(30,31)32)15-37-20-11-10-18(23(29)13-20)14-33-19-7-5-6-17(12-19)27(35)36/h3-13,16,33H,14-15H2,1-2H3,(H,35,36)
SMILES: CC(C)c1onc(-c2ccccc2OC(F)(F)F)c1COc1ccc(CN(C)c2cccc(C(=O)O)c2)c(Cl)c1
SELFIES: [C][C][Branch1][C][C][C][O][N][=C][Branch2][Ring1][C][C][=C][C][=C][C][=C][Ring1][=Branch1][O][C][Branch1][C][F][Branch1][C][F][F][C][=Ring1][S][C][O][C][=C][C][=C][Branch2][Ring1][Branch1][C][N][Branch1][C][C][C][=C][C][=C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][=C][Ring1][=Branch2][C][Branch1][C][Cl][=C][Ring2][Ring1][Ring1]
InChI: InChI=1S/C29H26ClF3N2O5/c1-17(2)27-23(26(34-40-27)22-9-4-5-10-25(22)39-29(31,32)33)16-38-21-12-11-19(24(30)14-21)15-35(3)20-8-6-7-18(13-20)28(36)37/h4-14,17H,15-16H2,1-3H3,(H,36,37)
SMILES: COC(=O)c1ccc(COc2ccc(OCc3c(-c4c(Cl)cccc4Cl)noc3C(C)C)cc2C)cc1
SELFIES: [C][O][C][=Branch1][C][=O][C][=C][C][=C][Branch2][Ring2][N][C][O][C][=C][C][=C][Branch2][Ring1][=N][O][C][C][C][Branch1][=N][C][=C][Branch1][C][Cl][C][=C][C][=C][Ring1][#Branch1][Cl][=N][O][C][=Ring1][=N][C][Branch1][C][C][C][C][=C][Ring2][Ring1][Branch2][C][C][=C][Ring2][Ring1][P]
InChI: InChI=1S/C29H27Cl2NO5/c1-17(2)28-22(27(32-37-28)26-23(30)6-5-7-24(26)31)16-35-21-12-13-25(18(3)14-21)36-15-19-8-10-20(11-9-19)29(33)34-4/h5-14,17H,15-16H2,1-4H3
SMILES: COC(=O)c1cccc(COc2ccc(OCc3c(-c4c(Cl)cccc4Cl)noc3C(C)C)cc2Cl)c1
SELFIES: [C][O][C][=Branch1][C][=O][C][=C][C][=C][C][Branch2][Ring2][N][C][O][C][=C][C][=C][Branch2][Ring1][=N][O][C][C][C][Branch1][=N][C][=C][Branch1][C][Cl][C][=C][C][=C][Ring1][#Branch1][Cl][=N][O][C][=Ring1][=N][C][Branch1][C][C][C][C][=C][Ring2][Ring1][Branch2][Cl][=C][Ring2][Ring1][P]
InChI: InChI=1S/C28H24Cl3NO5/c1-16(2)27-20(26(32-37-27)25-21(29)8-5-9-22(25)30)15-35-19-10-11-24(23(31)13-19)36-14-17-6-4-7-18(12-17)28(33)34-3/h4-13,16H,14-15H2,1-3H3
SMILES: COC(=O)c1cccc(COc2ccc(OCc3c(-c4c(Cl)cccc4Cl)noc3C(C)C)cc2C)c1
SELFIES: [C][O][C][=Branch1][C][=O][C][=C][C][=C][C][Branch2][Ring2][N][C][O][C][=C][C][=C][Branch2][Ring1][=N][O][C][C][C][Branch1][=N][C][=C][Branch1][C][Cl][C][=C][C][=C][Ring1][#Branch1][Cl][=N][O][C][=Ring1][=N][C][Branch1][C][C][C][C][=C][Ring2][Ring1][Branch2][C][=C][Ring2][Ring1][P]
InChI: InChI=1S/C29H27Cl2NO5/c1-17(2)28-22(27(32-37-28)26-23(30)9-6-10-24(26)31)16-35-21-11-12-25(18(3)13-21)36-15-19-7-5-8-20(14-19)29(33)34-4/h5-14,17H,15-16H2,1-4H3
SMILES: CC(C)c1onc(-c2c(Cl)cccc2Cl)c1COc1ccc(OCc2cccc(C(=O)O)c2)c(Cl)c1
SELFIES: [C][C][Branch1][C][C][C][O][N][=C][Branch1][=N][C][=C][Branch1][C][Cl][C][=C][C][=C][Ring1][#Branch1][Cl][C][=Ring1][=N][C][O][C][=C][C][=C][Branch2][Ring1][C][O][C][C][=C][C][=C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][=C][Ring1][=Branch2][C][Branch1][C][Cl][=C][Ring2][Ring1][C]
InChI: InChI=1S/C27H22Cl3NO5/c1-15(2)26-19(25(31-36-26)24-20(28)7-4-8-21(24)29)14-34-18-9-10-23(22(30)12-18)35-13-16-5-3-6-17(11-16)27(32)33/h3-12,15H,13-14H2,1-2H3,(H,32,33)
SMILES: Cc1cc(OCc2c(-c3c(Cl)cccc3Cl)noc2C(C)C)ccc1OCc1cccc(C(=O)O)c1
SELFIES: [C][C][=C][C][Branch2][Ring1][=N][O][C][C][C][Branch1][=N][C][=C][Branch1][C][Cl][C][=C][C][=C][Ring1][#Branch1][Cl][=N][O][C][=Ring1][=N][C][Branch1][C][C][C][=C][C][=C][Ring2][Ring1][Branch2][O][C][C][=C][C][=C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][=C][Ring1][=Branch2]
InChI: InChI=1S/C28H25Cl2NO5/c1-16(2)27-21(26(31-36-27)25-22(29)8-5-9-23(25)30)15-34-20-10-11-24(17(3)12-20)35-14-18-6-4-7-19(13-18)28(32)33/h4-13,16H,14-15H2,1-3H3,(H,32,33)
SMILES: Cc1cc(OCc2c(-c3c(Cl)cccc3Cl)noc2C(C)C)ccc1OCc1ccc(C(=O)O)cc1
SELFIES: [C][C][=C][C][Branch2][Ring1][=N][O][C][C][C][Branch1][=N][C][=C][Branch1][C][Cl][C][=C][C][=C][Ring1][#Branch1][Cl][=N][O][C][=Ring1][=N][C][Branch1][C][C][C][=C][C][=C][Ring2][Ring1][Branch2][O][C][C][=C][C][=C][Branch1][=Branch1][C][=Branch1][C][=O][O][C][=C][Ring1][=Branch2]
InChI: InChI=1S/C28H25Cl2NO5/c1-16(2)27-21(26(31-36-27)25-22(29)5-4-6-23(25)30)15-34-20-11-12-24(17(3)13-20)35-14-18-7-9-19(10-8-18)28(32)33/h4-13,16H,14-15H2,1-3H3,(H,32,33)
SMILES: Cc1cc(C)c(N2CCCC2)c(C)c1NC(=O)c1cccs1
SELFIES: [C][C][=C][C][Branch1][C][C][=C][Branch1][Branch2][N][C][C][C][C][Ring1][Branch1][C][Branch1][C][C][=C][Ring1][=N][N][C][=Branch1][C][=O][C][=C][C][=C][S][Ring1][Branch1]
InChI: InChI=1S/C18H22N2OS/c1-12-11-13(2)17(20-8-4-5-9-20)14(3)16(12)19-18(21)15-7-6-10-22-15/h6-7,10-11H,4-5,8-9H2,1-3H3,(H,19,21)
SMILES: Cc1cccc(C(=O)Nc2c(C)cc(C)c(N3CCCC3)c2C)c1
SELFIES: [C][C][=C][C][=C][C][Branch2][Ring1][=C][C][=Branch1][C][=O][N][C][=C][Branch1][C][C][C][=C][Branch1][C][C][C][Branch1][Branch2][N][C][C][C][C][Ring1][Branch1][=C][Ring1][=N][C][=C][Ring2][Ring1][#Branch1]
InChI: InChI=1S/C21H26N2O/c1-14-8-7-9-18(12-14)21(24)22-19-15(2)13-16(3)20(17(19)4)23-10-5-6-11-23/h7-9,12-13H,5-6,10-11H2,1-4H3,(H,22,24)
SMILES: Cc1cc(C)c(N2CCCC2)c(C)c1NC(=O)Cc1ccccc1
SELFIES: [C][C][=C][C][Branch1][C][C][=C][Branch1][Branch2][N][C][C][C][C][Ring1][Branch1][C][Branch1][C][C][=C][Ring1][=N][N][C][=Branch1][C][=O][C][C][=C][C][=C][C][=C][Ring1][=Branch1]
InChI: InChI=1S/C21H26N2O/c1-15-13-16(2)21(23-11-7-8-12-23)17(3)20(15)22-19(24)14-18-9-5-4-6-10-18/h4-6,9-10,13H,7-8,11-12,14H2,1-3H3,(H,22,24)
SMILES: Cc1cc(C)c(N2CCCC2)c(C)c1NC(=O)c1ccccc1Cl
SELFIES: [C][C][=C][C][Branch1][C][C][=C][Branch1][Branch2][N][C][C][C][C][Ring1][Branch1][C][Branch1][C][C][=C][Ring1][=N][N][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][Cl]
InChI: InChI=1S/C20H23ClN2O/c1-13-12-14(2)19(23-10-6-7-11-23)15(3)18(13)22-20(24)16-8-4-5-9-17(16)21/h4-5,8-9,12H,6-7,10-11H2,1-3H3,(H,22,24)
SMILES: Cc1cc(C)c(N2CCCC2)c(C)c1NC(=O)c1ccccc1OCc1ccccc1
SELFIES: [C][C][=C][C][Branch1][C][C][=C][Branch1][Branch2][N][C][C][C][C][Ring1][Branch1][C][Branch1][C][C][=C][Ring1][=N][N][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1]
InChI: InChI=1S/C27H30N2O2/c1-19-17-20(2)26(29-15-9-10-16-29)21(3)25(19)28-27(30)23-13-7-8-14-24(23)31-18-22-11-5-4-6-12-22/h4-8,11-14,17H,9-10,15-16,18H2,1-3H3,(H,28,30)