[2-[(2-ethylphenyl)amino]-2-oxidanylidene-ethyl] 3-(4-methylphenyl)thiophene-2-carboxylate

Systemtic Name: [2-[(2-ethylphenyl)amino]-2-oxidanylidene-ethyl] 3-(4-methylphenyl)thiophene-2-carboxylate Openeye Name: [2-(2-ethylanilino)-2-oxo-ethyl] 3-(p-tolyl)thiophene-2-carboxylate CAS Name: 3-(4-methylphenyl)-2-thiophenecarboxylic acid [2-(2-ethylanilino)-2-oxoethyl] ester IUPAC Name: [2-(2-ethylanilino)-2-oxoethyl] 3-(4-methylphenyl)thiophene-2-carboxylate Traditional Name: 3-(p-tolyl)thiophene-2-carboxylic acid [2-(2-ethylanilino)-2-keto-ethyl] ester Formula: C22H21NO3S MolecularWeight: 379.47204

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=O)COC(=O)C2=C(C=CS2)C3=CC=C(C=C3)C

Isomeric SMILES

CCC1=CC=CC=C1NC(=O)COC(=O)C2=C(C=CS2)C3=CC=C(C=C3)C

InChI

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