1-[2-[(1-oxidanyl-1-oxidanylidene-3-phenylsulfanyl-propan-2-yl)amino]propanoyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[2-[(1-oxidanyl-1-oxidanylidene-3-phenylsulfanyl-propan-2-yl)amino]propanoyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[2-[[2-hydroxy-2-oxo-1-(phenylsulfanylmethyl)ethyl]amino]propanoyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[2-[[1-hydroxy-1-oxo-3-(phenylthio)propan-2-yl]amino]-1-oxopropyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[2-[(1-hydroxy-1-oxo-3-phenylsulfanylpropan-2-yl)amino]propanoyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[2-[[2-hydroxy-2-keto-1-[(phenylthio)methyl]ethyl]amino]propanoyl]proline Formula: C17H22N2O5S MolecularWeight: 366.43198

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCCC1C(=O)O)NC(CSC2=CC=CC=C2)C(=O)O

Isomeric SMILES

CC(C(=O)N1CCCC1C(=O)O)NC(CSC2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C17H22N2O5S/c1-11(15(20)19-9-5-8-14(19)17(23)24)18-13(16(21)22)10-25-12-6-3-2-4-7-12/h2-4,6-7,11,13-14,18H,5,8-10H2,1H3,(H,21,22)(H,23,24)