[2-[(3,5-dimethoxyphenyl)amino]-2-oxidanylidene-ethyl] 1-thiophen-2-ylcarbonylpyrrolidine-2-carboxylate

Systemtic Name: [2-[(3,5-dimethoxyphenyl)amino]-2-oxidanylidene-ethyl] 1-thiophen-2-ylcarbonylpyrrolidine-2-carboxylate Openeye Name: [2-(3,5-dimethoxyanilino)-2-oxo-ethyl] 1-(thiophene-2-carbonyl)pyrrolidine-2-carboxylate CAS Name: 1-[oxo(thiophen-2-yl)methyl]-2-pyrrolidinecarboxylic acid [2-(3,5-dimethoxyanilino)-2-oxoethyl] ester IUPAC Name: [2-(3,5-dimethoxyanilino)-2-oxoethyl] 1-(thiophene-2-carbonyl)pyrrolidine-2-carboxylate Traditional Name: 1-(2-thenoyl)pyrrolidine-2-carboxylic acid [2-(3,5-dimethoxyanilino)-2-keto-ethyl] ester Formula: C20H22N2O6S MolecularWeight: 418.46348

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)NC(=O)COC(=O)C2CCCN2C(=O)C3=CC=CS3)OC

Isomeric SMILES

COC1=CC(=CC(=C1)NC(=O)COC(=O)C2CCCN2C(=O)C3=CC=CS3)OC

InChI

InChI=1S/C20H22N2O6S/c1-26-14-9-13(10-15(11-14)27-2)21-18(23)12-28-20(25)16-5-3-7-22(16)19(24)17-6-4-8-29-17/h4,6,8-11,16H,3,5,7,12H2,1-2H3,(H,21,23)