[2-[(2,4-dimethoxyphenyl)amino]-2-oxidanylidene-ethyl] (2S)-1-thiophen-2-ylcarbonylpyrrolidine-2-carboxylate

Systemtic Name: [2-[(2,4-dimethoxyphenyl)amino]-2-oxidanylidene-ethyl] (2S)-1-thiophen-2-ylcarbonylpyrrolidine-2-carboxylate Openeye Name: [2-(2,4-dimethoxyanilino)-2-oxo-ethyl] (2S)-1-(thiophene-2-carbonyl)pyrrolidine-2-carboxylate CAS Name: (2S)-1-[oxo(thiophen-2-yl)methyl]-2-pyrrolidinecarboxylic acid [2-(2,4-dimethoxyanilino)-2-oxoethyl] ester IUPAC Name: [2-(2,4-dimethoxyanilino)-2-oxoethyl] (2S)-1-(thiophene-2-carbonyl)pyrrolidine-2-carboxylate Traditional Name: (2S)-1-(2-thenoyl)pyrrolidine-2-carboxylic acid [2-(2,4-dimethoxyanilino)-2-keto-ethyl] ester Formula: C20H22N2O6S MolecularWeight: 418.46348

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

COC1=CC(=C(C=C1)NC(=O)COC(=O)[C@@H]2CCCN2C(=O)C3=CC=CS3)OC

InChI

InChI=1S/C20H22N2O6S/c1-26-13-7-8-14(16(11-13)27-2)21-18(23)12-28-20(25)15-5-3-9-22(15)19(24)17-6-4-10-29-17/h4,6-8,10-11,15H,3,5,9,12H2,1-2H3,(H,21,23)/t15-/m0/s1