1-[4-(phenylmethylsulfanyl)carbonylsulfanylbutanoyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[4-(phenylmethylsulfanyl)carbonylsulfanylbutanoyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-(4-benzylsulfanylcarbonylsulfanylbutanoyl)pyrrolidine-2-carboxylic acid CAS Name: 1-[1-oxo-4-[[oxo-(phenylmethylthio)methyl]thio]butyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-(4-benzylsulfanylcarbonylsulfanylbutanoyl)pyrrolidine-2-carboxylic acid Traditional Name: 1-[4-[(benzylthio)carbonylthio]butanoyl]proline Formula: C17H21NO4S2 MolecularWeight: 367.48294

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H21NO4S2/c19-15(18-10-4-8-14(18)16(20)21)9-5-11-23-17(22)24-12-13-6-2-1-3-7-13/h1-3,6-7,14H,4-5,8-12H2,(H,20,21)