ethyl 2-(2,3-diphenylprop-2-enoylamino)-5-methyl-4-(4-nitrophenyl)thiophene-3-carboxylate

Systemtic Name: ethyl 2-(2,3-diphenylprop-2-enoylamino)-5-methyl-4-(4-nitrophenyl)thiophene-3-carboxylate Openeye Name: ethyl 2-(2,3-diphenylprop-2-enoylamino)-5-methyl-4-(4-nitrophenyl)thiophene-3-carboxylate CAS Name: 5-methyl-4-(4-nitrophenyl)-2-[(1-oxo-2,3-diphenylprop-2-enyl)amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-(2,3-diphenylprop-2-enoylamino)-5-methyl-4-(4-nitrophenyl)thiophene-3-carboxylate Traditional Name: 2-[(2,3-diphenylacryloyl)amino]-5-methyl-4-(4-nitrophenyl)thiophene-3-carboxylic acid ethyl ester Formula: C29H24N2O5S MolecularWeight: 512.57626

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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)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C2=CC=C(C=C2)[N+](=O)[O-])C)NC(=O)C(=CC3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C29H24N2O5S/c1-3-36-29(33)26-25(22-14-16-23(17-15-22)31(34)35)19(2)37-28(26)30-27(32)24(21-12-8-5-9-13-21)18-20-10-6-4-7-11-20/h4-18H,3H2,1-2H3,(H,30,32)