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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H17NO4S/c1-10(21-15(20)11-6-3-2-4-7-11)13(17)16-9-5-8-12(16)14(18)19/h2-4,6-7,10,12H,5,8-9H2,1H3,(H,18,19)