ethyl 4-(4-chlorophenyl)-2-(2,3-diphenylprop-2-enoylamino)thiophene-3-carboxylate

Systemtic Name: ethyl 4-(4-chlorophenyl)-2-(2,3-diphenylprop-2-enoylamino)thiophene-3-carboxylate Openeye Name: ethyl 4-(4-chlorophenyl)-2-(2,3-diphenylprop-2-enoylamino)thiophene-3-carboxylate CAS Name: 4-(4-chlorophenyl)-2-[(1-oxo-2,3-diphenylprop-2-enyl)amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-chlorophenyl)-2-(2,3-diphenylprop-2-enoylamino)thiophene-3-carboxylate Traditional Name: 4-(4-chlorophenyl)-2-[(2,3-diphenylacryloyl)amino]thiophene-3-carboxylic acid ethyl ester Formula: C28H22ClNO3S MolecularWeight: 487.99718

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)Cl)NC(=O)C(=CC3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)Cl)NC(=O)C(=CC3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C28H22ClNO3S/c1-2-33-28(32)25-24(21-13-15-22(29)16-14-21)18-34-27(25)30-26(31)23(20-11-7-4-8-12-20)17-19-9-5-3-6-10-19/h3-18H,2H2,1H3,(H,30,31)