methyl 4-(3-chlorophenyl)-2-(2,2-diphenylethanoylamino)-5-methyl-thiophene-3-carboxylate

Systemtic Name: methyl 4-(3-chlorophenyl)-2-(2,2-diphenylethanoylamino)-5-methyl-thiophene-3-carboxylate Openeye Name: methyl 4-(3-chlorophenyl)-2-[(2,2-diphenylacetyl)amino]-5-methyl-thiophene-3-carboxylate CAS Name: 4-(3-chlorophenyl)-5-methyl-2-[(1-oxo-2,2-diphenylethyl)amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4-(3-chlorophenyl)-2-[(2,2-diphenylacetyl)amino]-5-methylthiophene-3-carboxylate Traditional Name: 4-(3-chlorophenyl)-2-[(2,2-diphenylacetyl)amino]-5-methyl-thiophene-3-carboxylic acid methyl ester Formula: C27H22ClNO3S MolecularWeight: 475.98648

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(S1)NC(=O)C(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)OC)C4=CC(=CC=C4)Cl

Isomeric SMILES

CC1=C(C(=C(S1)NC(=O)C(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)OC)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C27H22ClNO3S/c1-17-22(20-14-9-15-21(28)16-20)24(27(31)32-2)26(33-17)29-25(30)23(18-10-5-3-6-11-18)19-12-7-4-8-13-19/h3-16,23H,1-2H3,(H,29,30)