Molecule ID: 1001206

IUPAC Name: 2-O-ethyl 4-O-propan-2-yl 5-[[(E)-3-(1,5-dimethylpyrazol-4-yl)prop-2-enoyl]amino]-3-methylthiophene-2,4-dicarboxylate

Description: The molecule is a secondary carboxamide, an ethyl ester, an isopropyl ester, a member of thiophenes and a member of pyrazoles.

SMILES: CCOC(=O)c1sc(N=C(O)/C=C/c2cnn(C)c2C)c(C(=O)OC(C)C)c1C

SELFIES: [C][C][O][C][=Branch1][C][=O][C][S][C][Branch2][Ring1][Ring1][N][=C][Branch1][C][O][/C][=C][/C][C][=N][N][Branch1][C][C][C][=Ring1][=Branch1][C][=C][Branch1][O][C][=Branch1][C][=O][O][C][Branch1][C][C][C][C][=Ring2][Ring1][#Branch1][C]

InChI: InChI=1S/C20H25N3O5S/c1-7-27-20(26)17-12(4)16(19(25)28-11(2)3)18(29-17)22-15(24)9-8-14-10-21-23(6)13(14)5/h8-11H,7H2,1-6H3,(H,22,24)/b9-8+

Molecular Properties:
- Polar Surface Area: 128.0 Ų
- LogP: 4.0