methyl 2-[[(E)-2-cyano-3-[3-methoxy-4-(4-methylphenyl)carbonyloxy-phenyl]prop-2-enoyl]amino]-5-phenyl-thiophene-3-carboxylate

Systemtic Name: methyl 2-[[(E)-2-cyano-3-[3-methoxy-4-(4-methylphenyl)carbonyloxy-phenyl]prop-2-enoyl]amino]-5-phenyl-thiophene-3-carboxylate Openeye Name: methyl 2-[[(E)-2-cyano-3-[3-methoxy-4-(4-methylbenzoyl)oxy-phenyl]prop-2-enoyl]amino]-5-phenyl-thiophene-3-carboxylate CAS Name: 2-[[(E)-2-cyano-3-[3-methoxy-4-[(4-methylphenyl)-oxomethoxy]phenyl]-1-oxoprop-2-enyl]amino]-5-phenyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[[(E)-2-cyano-3-[3-methoxy-4-(4-methylbenzoyl)oxyphenyl]prop-2-enoyl]amino]-5-phenylthiophene-3-carboxylate Traditional Name: 2-[[(E)-2-cyano-3-(3-methoxy-4-p-toluoyloxy-phenyl)acryloyl]amino]-5-phenyl-thiophene-3-carboxylic acid methyl ester Formula: C31H24N2O6S MolecularWeight: 552.59706

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)OC2=C(C=C(C=C2)C=C(C#N)C(=O)NC3=C(C=C(S3)C4=CC=CC=C4)C(=O)OC)OC

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)OC2=C(C=C(C=C2)/C=C(\C#N)/C(=O)NC3=C(C=C(S3)C4=CC=CC=C4)C(=O)OC)OC

InChI

InChI=1S/C31H24N2O6S/c1-19-9-12-22(13-10-19)30(35)39-25-14-11-20(16-26(25)37-2)15-23(18-32)28(34)33-29-24(31(36)38-3)17-27(40-29)21-7-5-4-6-8-21/h4-17H,1-3H3,(H,33,34)/b23-15+