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

Systemtic Name: 1-[2-(ethanoylsulfanylmethyl)butanoyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[2-(acetylsulfanylmethyl)butanoyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[2-[(acetylthio)methyl]-1-oxobutyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[2-(acetylsulfanylmethyl)butanoyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[2-[(acetylthio)methyl]butanoyl]proline Formula: C12H19NO4S MolecularWeight: 273.34856

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CSC(=O)C)C(=O)N1CCCC1C(=O)O

Isomeric SMILES

CCC(CSC(=O)C)C(=O)N1CCCC1C(=O)O

InChI

InChI=1S/C12H19NO4S/c1-3-9(7-18-8(2)14)11(15)13-6-4-5-10(13)12(16)17/h9-10H,3-7H2,1-2H3,(H,16,17)