ethyl 2-(3,3-diphenylpropanoylamino)-4-(4-methylphenyl)thiophene-3-carboxylate

Systemtic Name: ethyl 2-(3,3-diphenylpropanoylamino)-4-(4-methylphenyl)thiophene-3-carboxylate Openeye Name: ethyl 2-(3,3-diphenylpropanoylamino)-4-(p-tolyl)thiophene-3-carboxylate CAS Name: 4-(4-methylphenyl)-2-[(1-oxo-3,3-diphenylpropyl)amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-(3,3-diphenylpropanoylamino)-4-(4-methylphenyl)thiophene-3-carboxylate Traditional Name: 2-(3,3-diphenylpropanoylamino)-4-(p-tolyl)thiophene-3-carboxylic acid ethyl ester Formula: C29H27NO3S MolecularWeight: 469.59458

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H27NO3S/c1-3-33-29(32)27-25(23-16-14-20(2)15-17-23)19-34-28(27)30-26(31)18-24(21-10-6-4-7-11-21)22-12-8-5-9-13-22/h4-17,19,24H,3,18H2,1-2H3,(H,30,31)