1-[2-(phenylmethylsulfanyl)carbonylsulfanylpropanoyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[2-(phenylmethylsulfanyl)carbonylsulfanylpropanoyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-(2-benzylsulfanylcarbonylsulfanylpropanoyl)pyrrolidine-2-carboxylic acid CAS Name: 1-[1-oxo-2-[[oxo-(phenylmethylthio)methyl]thio]propyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-(2-benzylsulfanylcarbonylsulfanylpropanoyl)pyrrolidine-2-carboxylic acid Traditional Name: 1-[2-[(benzylthio)carbonylthio]propanoyl]proline Formula: C16H19NO4S2 MolecularWeight: 353.45636

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCCC1C(=O)O)SC(=O)SCC2=CC=CC=C2

Isomeric SMILES

CC(C(=O)N1CCCC1C(=O)O)SC(=O)SCC2=CC=CC=C2

InChI

InChI=1S/C16H19NO4S2/c1-11(14(18)17-9-5-8-13(17)15(19)20)23-16(21)22-10-12-6-3-2-4-7-12/h2-4,6-7,11,13H,5,8-10H2,1H3,(H,19,20)