1-[3-(phenylmethylsulfanyl)carbonylsulfanylpropanoyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[3-(phenylmethylsulfanyl)carbonylsulfanylpropanoyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-(3-benzylsulfanylcarbonylsulfanylpropanoyl)pyrrolidine-2-carboxylic acid CAS Name: 1-[1-oxo-3-[[oxo-(phenylmethylthio)methyl]thio]propyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-(3-benzylsulfanylcarbonylsulfanylpropanoyl)pyrrolidine-2-carboxylic acid Traditional Name: 1-[3-[(benzylthio)carbonylthio]propanoyl]proline Formula: C16H19NO4S2 MolecularWeight: 353.45636

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)CCSC(=O)SCC2=CC=CC=C2)C(=O)O

Isomeric SMILES

C1CC(N(C1)C(=O)CCSC(=O)SCC2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C16H19NO4S2/c18-14(17-9-4-7-13(17)15(19)20)8-10-22-16(21)23-11-12-5-2-1-3-6-12/h1-3,5-6,13H,4,7-11H2,(H,19,20)