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

Systemtic Name: 1-[3-(phenylcarbonylsulfanyl)propanoyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-(3-benzoylsulfanylpropanoyl)pyrrolidine-2-carboxylic acid CAS Name: 1-[3-(benzoylthio)-1-oxopropyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-(3-benzoylsulfanylpropanoyl)pyrrolidine-2-carboxylic acid Traditional Name: 1-[3-(benzoylthio)propanoyl]proline Formula: C15H17NO4S MolecularWeight: 307.36478

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H17NO4S/c17-13(16-9-4-7-12(16)14(18)19)8-10-21-15(20)11-5-2-1-3-6-11/h1-3,5-6,12H,4,7-10H2,(H,18,19)