ethyl 2-[(2-cyano-3-phenyl-prop-2-enoyl)amino]-4-(4-methylphenyl)thiophene-3-carboxylate

Systemtic Name: ethyl 2-[(2-cyano-3-phenyl-prop-2-enoyl)amino]-4-(4-methylphenyl)thiophene-3-carboxylate Openeye Name: ethyl 2-[(2-cyano-3-phenyl-prop-2-enoyl)amino]-4-(p-tolyl)thiophene-3-carboxylate CAS Name: 2-[(2-cyano-1-oxo-3-phenylprop-2-enyl)amino]-4-(4-methylphenyl)-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(2-cyano-3-phenylprop-2-enoyl)amino]-4-(4-methylphenyl)thiophene-3-carboxylate Traditional Name: 2-[(2-cyano-3-phenyl-acryloyl)amino]-4-(p-tolyl)thiophene-3-carboxylic acid ethyl ester Formula: C24H20N2O3S MolecularWeight: 416.4922

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)C)NC(=O)C(=CC3=CC=CC=C3)C#N

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)C)NC(=O)C(=CC3=CC=CC=C3)C#N

InChI

InChI=1S/C24H20N2O3S/c1-3-29-24(28)21-20(18-11-9-16(2)10-12-18)15-30-23(21)26-22(27)19(14-25)13-17-7-5-4-6-8-17/h4-13,15H,3H2,1-2H3,(H,26,27)