1-(3-ethanoylsulfanyl-2-methylsulfanyl-propanoyl)-4,4-dimethoxy-pyrrolidine-2-carboxylic acid

Systemtic Name: 1-(3-ethanoylsulfanyl-2-methylsulfanyl-propanoyl)-4,4-dimethoxy-pyrrolidine-2-carboxylic acid Openeye Name: 1-(3-acetylsulfanyl-2-methylsulfanyl-propanoyl)-4,4-dimethoxy-pyrrolidine-2-carboxylic acid CAS Name: 1-[3-(acetylthio)-2-(methylthio)-1-oxopropyl]-4,4-dimethoxy-2-pyrrolidinecarboxylic acid IUPAC Name: 1-(3-acetylsulfanyl-2-methylsulfanylpropanoyl)-4,4-dimethoxypyrrolidine-2-carboxylic acid Traditional Name: 1-[3-(acetylthio)-2-(methylthio)propanoyl]-4,4-dimethoxy-proline Formula: C13H21NO6S2 MolecularWeight: 351.43894

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SCC(C(=O)N1CC(CC1C(=O)O)(OC)OC)SC

Isomeric SMILES

CC(=O)SCC(C(=O)N1CC(CC1C(=O)O)(OC)OC)SC

InChI

InChI=1S/C13H21NO6S2/c1-8(15)22-6-10(21-4)11(16)14-7-13(19-2,20-3)5-9(14)12(17)18/h9-10H,5-7H2,1-4H3,(H,17,18)