methyl 5-methyl-4-phenyl-2-(3-phenylpropanoylamino)thiophene-3-carboxylate

Systemtic Name: methyl 5-methyl-4-phenyl-2-(3-phenylpropanoylamino)thiophene-3-carboxylate Openeye Name: methyl 5-methyl-4-phenyl-2-(3-phenylpropanoylamino)thiophene-3-carboxylate CAS Name: 5-methyl-2-[(1-oxo-3-phenylpropyl)amino]-4-phenyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-methyl-4-phenyl-2-(3-phenylpropanoylamino)thiophene-3-carboxylate Traditional Name: 2-(hydrocinnamoylamino)-5-methyl-4-phenyl-thiophene-3-carboxylic acid methyl ester Formula: C22H21NO3S MolecularWeight: 379.47204

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(S1)NC(=O)CCC2=CC=CC=C2)C(=O)OC)C3=CC=CC=C3

Isomeric SMILES

CC1=C(C(=C(S1)NC(=O)CCC2=CC=CC=C2)C(=O)OC)C3=CC=CC=C3

InChI

InChI=1S/C22H21NO3S/c1-15-19(17-11-7-4-8-12-17)20(22(25)26-2)21(27-15)23-18(24)14-13-16-9-5-3-6-10-16/h3-12H,13-14H2,1-2H3,(H,23,24)