methyl 2-[(2-cyano-3-phenyl-prop-2-enoyl)amino]-4-(4-ethoxyphenyl)-5-methyl-thiophene-3-carboxylate

Systemtic Name: methyl 2-[(2-cyano-3-phenyl-prop-2-enoyl)amino]-4-(4-ethoxyphenyl)-5-methyl-thiophene-3-carboxylate Openeye Name: methyl 2-[(2-cyano-3-phenyl-prop-2-enoyl)amino]-4-(4-ethoxyphenyl)-5-methyl-thiophene-3-carboxylate CAS Name: 2-[(2-cyano-1-oxo-3-phenylprop-2-enyl)amino]-4-(4-ethoxyphenyl)-5-methyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[(2-cyano-3-phenylprop-2-enoyl)amino]-4-(4-ethoxyphenyl)-5-methylthiophene-3-carboxylate Traditional Name: 2-[(2-cyano-3-phenyl-acryloyl)amino]-5-methyl-4-p-phenetyl-thiophene-3-carboxylic acid methyl ester Formula: C25H22N2O4S MolecularWeight: 446.51818

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=C(SC(=C2C(=O)OC)NC(=O)C(=CC3=CC=CC=C3)C#N)C

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=C(SC(=C2C(=O)OC)NC(=O)C(=CC3=CC=CC=C3)C#N)C

InChI

InChI=1S/C25H22N2O4S/c1-4-31-20-12-10-18(11-13-20)21-16(2)32-24(22(21)25(29)30-3)27-23(28)19(15-26)14-17-8-6-5-7-9-17/h5-14H,4H2,1-3H3,(H,27,28)