1-[2-(ethanoylsulfanylmethyl)butanoyl]-4-oxidanylidene-pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[2-(ethanoylsulfanylmethyl)butanoyl]-4-oxidanylidene-pyrrolidine-2-carboxylic acid Openeye Name: 1-[2-(acetylsulfanylmethyl)butanoyl]-4-oxo-pyrrolidine-2-carboxylic acid CAS Name: 1-[2-[(acetylthio)methyl]-1-oxobutyl]-4-oxo-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[2-(acetylsulfanylmethyl)butanoyl]-4-oxopyrrolidine-2-carboxylic acid Traditional Name: 1-[2-[(acetylthio)methyl]butanoyl]-4-keto-proline Formula: C12H17NO5S MolecularWeight: 287.33208

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CSC(=O)C)C(=O)N1CC(=O)CC1C(=O)O

Isomeric SMILES

CCC(CSC(=O)C)C(=O)N1CC(=O)CC1C(=O)O

InChI

InChI=1S/C12H17NO5S/c1-3-8(6-19-7(2)14)11(16)13-5-9(15)4-10(13)12(17)18/h8,10H,3-6H2,1-2H3,(H,17,18)