1-[2-(phenylcarbonylsulfanyl)cyclopropyl]carbonylpyrrolidine-2-carboxylic acid

Systemtic Name: 1-[2-(phenylcarbonylsulfanyl)cyclopropyl]carbonylpyrrolidine-2-carboxylic acid Openeye Name: 1-(2-benzoylsulfanylcyclopropanecarbonyl)pyrrolidine-2-carboxylic acid CAS Name: 1-[[2-(benzoylthio)cyclopropyl]-oxomethyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-(2-benzoylsulfanylcyclopropanecarbonyl)pyrrolidine-2-carboxylic acid Traditional Name: 1-[2-(benzoylthio)cyclopropanecarbonyl]proline Formula: C16H17NO4S MolecularWeight: 319.37548

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C2CC2SC(=O)C3=CC=CC=C3)C(=O)O

Isomeric SMILES

C1CC(N(C1)C(=O)C2CC2SC(=O)C3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C16H17NO4S/c18-14(17-8-4-7-12(17)15(19)20)11-9-13(11)22-16(21)10-5-2-1-3-6-10/h1-3,5-6,11-13H,4,7-9H2,(H,19,20)