ethyl 4-(3,4-dimethylphenyl)-2-(3-phenylpropanoylamino)thiophene-3-carboxylate

Systemtic Name: ethyl 4-(3,4-dimethylphenyl)-2-(3-phenylpropanoylamino)thiophene-3-carboxylate Openeye Name: ethyl 4-(3,4-dimethylphenyl)-2-(3-phenylpropanoylamino)thiophene-3-carboxylate CAS Name: 4-(3,4-dimethylphenyl)-2-[(1-oxo-3-phenylpropyl)amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(3,4-dimethylphenyl)-2-(3-phenylpropanoylamino)thiophene-3-carboxylate Traditional Name: 4-(3,4-dimethylphenyl)-2-(hydrocinnamoylamino)thiophene-3-carboxylic acid ethyl ester Formula: C24H25NO3S MolecularWeight: 407.5252

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC(=C(C=C2)C)C)NC(=O)CCC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC(=C(C=C2)C)C)NC(=O)CCC3=CC=CC=C3

InChI

InChI=1S/C24H25NO3S/c1-4-28-24(27)22-20(19-12-10-16(2)17(3)14-19)15-29-23(22)25-21(26)13-11-18-8-6-5-7-9-18/h5-10,12,14-15H,4,11,13H2,1-3H3,(H,25,26)