[2-(ethoxycarbonylamino)-2-oxidanylidene-ethyl] 1-(4-methylphenyl)-5-oxidanylidene-2-thiophen-2-yl-pyrrolidine-3-carboxylate

Systemtic Name: [2-(ethoxycarbonylamino)-2-oxidanylidene-ethyl] 1-(4-methylphenyl)-5-oxidanylidene-2-thiophen-2-yl-pyrrolidine-3-carboxylate Openeye Name: [2-(ethoxycarbonylamino)-2-oxo-ethyl] 5-oxo-1-(p-tolyl)-2-(2-thienyl)pyrrolidine-3-carboxylate CAS Name: 1-(4-methylphenyl)-5-oxo-2-thiophen-2-yl-3-pyrrolidinecarboxylic acid [2-(ethoxycarbonylamino)-2-oxoethyl] ester IUPAC Name: [2-(ethoxycarbonylamino)-2-oxoethyl] 1-(4-methylphenyl)-5-oxo-2-thiophen-2-ylpyrrolidine-3-carboxylate Traditional Name: 5-keto-1-(p-tolyl)-2-(2-thienyl)pyrrolidine-3-carboxylic acid [2-(carbethoxyamino)-2-keto-ethyl] ester Formula: C21H22N2O6S MolecularWeight: 430.47418

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NC(=O)COC(=O)C1CC(=O)N(C1C2=CC=CS2)C3=CC=C(C=C3)C

Isomeric SMILES

CCOC(=O)NC(=O)COC(=O)C1CC(=O)N(C1C2=CC=CS2)C3=CC=C(C=C3)C

InChI

InChI=1S/C21H22N2O6S/c1-3-28-21(27)22-17(24)12-29-20(26)15-11-18(25)23(14-8-6-13(2)7-9-14)19(15)16-5-4-10-30-16/h4-10,15,19H,3,11-12H2,1-2H3,(H,22,24,27)