methyl 4-methyl-2-[(4-methylphenyl)carbonylamino]-5-(phenylmethyl)thiophene-3-carboxylate

Systemtic Name: methyl 4-methyl-2-[(4-methylphenyl)carbonylamino]-5-(phenylmethyl)thiophene-3-carboxylate Openeye Name: methyl 5-benzyl-4-methyl-2-[(4-methylbenzoyl)amino]thiophene-3-carboxylate CAS Name: 4-methyl-2-[[(4-methylphenyl)-oxomethyl]amino]-5-(phenylmethyl)-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-benzyl-4-methyl-2-[(4-methylbenzoyl)amino]thiophene-3-carboxylate Traditional Name: 5-benzyl-4-methyl-2-(p-toluoylamino)thiophene-3-carboxylic acid methyl ester Formula: C22H21NO3S MolecularWeight: 379.47204

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NC2=C(C(=C(S2)CC3=CC=CC=C3)C)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)NC2=C(C(=C(S2)CC3=CC=CC=C3)C)C(=O)OC

InChI

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