ethyl 1-phenyl-5-(2-sulfanylethylcarbamoyl)pyrrolidine-2-carboxylate

Systemtic Name: ethyl 1-phenyl-5-(2-sulfanylethylcarbamoyl)pyrrolidine-2-carboxylate Openeye Name: ethyl 1-phenyl-5-(2-sulfanylethylcarbamoyl)pyrrolidine-2-carboxylate CAS Name: 5-[(2-mercaptoethylamino)-oxomethyl]-1-phenyl-2-pyrrolidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-phenyl-5-(2-sulfanylethylcarbamoyl)pyrrolidine-2-carboxylate Traditional Name: 5-(2-mercaptoethylcarbamoyl)-1-phenyl-pyrrolidine-2-carboxylic acid ethyl ester Formula: C16H22N2O3S MolecularWeight: 322.42248

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCC(N1C2=CC=CC=C2)C(=O)NCCS

Isomeric SMILES

CCOC(=O)C1CCC(N1C2=CC=CC=C2)C(=O)NCCS

InChI

InChI=1S/C16H22N2O3S/c1-2-21-16(20)14-9-8-13(15(19)17-10-11-22)18(14)12-6-4-3-5-7-12/h3-7,13-14,22H,2,8-11H2,1H3,(H,17,19)