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

Systemtic Name: ethyl 2-[(2-cyano-3-phenyl-prop-2-enoyl)amino]-5-methyl-4-(4-nitrophenyl)thiophene-3-carboxylate Openeye Name: ethyl 2-[(2-cyano-3-phenyl-prop-2-enoyl)amino]-5-methyl-4-(4-nitrophenyl)thiophene-3-carboxylate CAS Name: 2-[(2-cyano-1-oxo-3-phenylprop-2-enyl)amino]-5-methyl-4-(4-nitrophenyl)-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(2-cyano-3-phenylprop-2-enoyl)amino]-5-methyl-4-(4-nitrophenyl)thiophene-3-carboxylate Traditional Name: 2-[(2-cyano-3-phenyl-acryloyl)amino]-5-methyl-4-(4-nitrophenyl)thiophene-3-carboxylic acid ethyl ester Formula: C24H19N3O5S MolecularWeight: 461.48976

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H19N3O5S/c1-3-32-24(29)21-20(17-9-11-19(12-10-17)27(30)31)15(2)33-23(21)26-22(28)18(14-25)13-16-7-5-4-6-8-16/h4-13H,3H2,1-2H3,(H,26,28)