1-[1-(phenylcarbonylsulfanyl)propan-2-ylsulfonyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[1-(phenylcarbonylsulfanyl)propan-2-ylsulfonyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-(2-benzoylsulfanyl-1-methyl-ethyl)sulfonylpyrrolidine-2-carboxylic acid CAS Name: 1-[1-(benzoylthio)propan-2-ylsulfonyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-(1-benzoylsulfanylpropan-2-ylsulfonyl)pyrrolidine-2-carboxylic acid Traditional Name: 1-[2-(benzoylthio)-1-methyl-ethyl]sulfonylproline Formula: C15H19NO5S2 MolecularWeight: 357.44506

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Descriptors Computed from Structure

Canonical SMILES:

CC(CSC(=O)C1=CC=CC=C1)S(=O)(=O)N2CCCC2C(=O)O

Isomeric SMILES

CC(CSC(=O)C1=CC=CC=C1)S(=O)(=O)N2CCCC2C(=O)O

InChI

InChI=1S/C15H19NO5S2/c1-11(10-22-15(19)12-6-3-2-4-7-12)23(20,21)16-9-5-8-13(16)14(17)18/h2-4,6-7,11,13H,5,8-10H2,1H3,(H,17,18)