1-[2-(ethanoylsulfanylmethyl)-3-methylsulfanyl-propanoyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[2-(ethanoylsulfanylmethyl)-3-methylsulfanyl-propanoyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[2-(acetylsulfanylmethyl)-3-methylsulfanyl-propanoyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[2-[(acetylthio)methyl]-3-(methylthio)-1-oxopropyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[2-(acetylsulfanylmethyl)-3-methylsulfanylpropanoyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[2-[(acetylthio)methyl]-3-(methylthio)propanoyl]proline Formula: C12H19NO4S2 MolecularWeight: 305.41356

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SCC(CSC)C(=O)N1CCCC1C(=O)O

Isomeric SMILES

CC(=O)SCC(CSC)C(=O)N1CCCC1C(=O)O

InChI

InChI=1S/C12H19NO4S2/c1-8(14)19-7-9(6-18-2)11(15)13-5-3-4-10(13)12(16)17/h9-10H,3-7H2,1-2H3,(H,16,17)