methyl 2-(4-phenylbutanoylamino)-4-(4-phenylphenyl)thiophene-3-carboxylate

Systemtic Name: methyl 2-(4-phenylbutanoylamino)-4-(4-phenylphenyl)thiophene-3-carboxylate Openeye Name: methyl 2-(4-phenylbutanoylamino)-4-(4-phenylphenyl)thiophene-3-carboxylate CAS Name: 2-[(1-oxo-4-phenylbutyl)amino]-4-(4-phenylphenyl)-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-(4-phenylbutanoylamino)-4-(4-phenylphenyl)thiophene-3-carboxylate Traditional Name: 2-(4-phenylbutanoylamino)-4-(4-phenylphenyl)thiophene-3-carboxylic acid methyl ester Formula: C28H25NO3S MolecularWeight: 455.568

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(SC=C1C2=CC=C(C=C2)C3=CC=CC=C3)NC(=O)CCCC4=CC=CC=C4

Isomeric SMILES

COC(=O)C1=C(SC=C1C2=CC=C(C=C2)C3=CC=CC=C3)NC(=O)CCCC4=CC=CC=C4

InChI

InChI=1S/C28H25NO3S/c1-32-28(31)26-24(23-17-15-22(16-18-23)21-12-6-3-7-13-21)19-33-27(26)29-25(30)14-8-11-20-9-4-2-5-10-20/h2-7,9-10,12-13,15-19H,8,11,14H2,1H3,(H,29,30)