methyl 4,5-dimethyl-2-[[2-(phenylmethyl)phenyl]carbonylamino]thiophene-3-carboxylate

Systemtic Name: methyl 4,5-dimethyl-2-[[2-(phenylmethyl)phenyl]carbonylamino]thiophene-3-carboxylate Openeye Name: methyl 2-[(2-benzylbenzoyl)amino]-4,5-dimethyl-thiophene-3-carboxylate CAS Name: 4,5-dimethyl-2-[[oxo-[2-(phenylmethyl)phenyl]methyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[(2-benzylbenzoyl)amino]-4,5-dimethylthiophene-3-carboxylate Traditional Name: 2-[(2-benzylbenzoyl)amino]-4,5-dimethyl-thiophene-3-carboxylic acid methyl ester Formula: C22H21NO3S MolecularWeight: 379.47204

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC)NC(=O)C2=CC=CC=C2CC3=CC=CC=C3)C

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC)NC(=O)C2=CC=CC=C2CC3=CC=CC=C3)C

InChI

InChI=1S/C22H21NO3S/c1-14-15(2)27-21(19(14)22(25)26-3)23-20(24)18-12-8-7-11-17(18)13-16-9-5-4-6-10-16/h4-12H,13H2,1-3H3,(H,23,24)