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

Systemtic Name: methyl 2-(2,2-diphenylethanoylamino)-5-methyl-4-phenyl-thiophene-3-carboxylate Openeye Name: methyl 2-[(2,2-diphenylacetyl)amino]-5-methyl-4-phenyl-thiophene-3-carboxylate CAS Name: 5-methyl-2-[(1-oxo-2,2-diphenylethyl)amino]-4-phenyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[(2,2-diphenylacetyl)amino]-5-methyl-4-phenylthiophene-3-carboxylate Traditional Name: 2-[(2,2-diphenylacetyl)amino]-5-methyl-4-phenyl-thiophene-3-carboxylic acid methyl ester Formula: C27H23NO3S MolecularWeight: 441.54142

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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

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

InChI

InChI=1S/C27H23NO3S/c1-18-22(19-12-6-3-7-13-19)24(27(30)31-2)26(32-18)28-25(29)23(20-14-8-4-9-15-20)21-16-10-5-11-17-21/h3-17,23H,1-2H3,(H,28,29)