[2-(butan-2-ylamino)-2-oxidanylidene-ethyl] 1-thiophen-2-ylcarbonylpyrrolidine-2-carboxylate

Systemtic Name: [2-(butan-2-ylamino)-2-oxidanylidene-ethyl] 1-thiophen-2-ylcarbonylpyrrolidine-2-carboxylate Openeye Name: [2-oxo-2-(sec-butylamino)ethyl] 1-(thiophene-2-carbonyl)pyrrolidine-2-carboxylate CAS Name: 1-[oxo(thiophen-2-yl)methyl]-2-pyrrolidinecarboxylic acid [2-(butan-2-ylamino)-2-oxoethyl] ester IUPAC Name: [2-(butan-2-ylamino)-2-oxoethyl] 1-(thiophene-2-carbonyl)pyrrolidine-2-carboxylate Traditional Name: 1-(2-thenoyl)pyrrolidine-2-carboxylic acid [2-keto-2-(sec-butylamino)ethyl] ester Formula: C16H22N2O4S MolecularWeight: 338.42188

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)COC(=O)C1CCCN1C(=O)C2=CC=CS2

Isomeric SMILES

CCC(C)NC(=O)COC(=O)C1CCCN1C(=O)C2=CC=CS2

InChI

InChI=1S/C16H22N2O4S/c1-3-11(2)17-14(19)10-22-16(21)12-6-4-8-18(12)15(20)13-7-5-9-23-13/h5,7,9,11-12H,3-4,6,8,10H2,1-2H3,(H,17,19)