4-benzamido-1-(2-methyl-3-sulfanyl-propanoyl)piperidine-2-carboxylic acid

Systemtic Name: 4-benzamido-1-(2-methyl-3-sulfanyl-propanoyl)piperidine-2-carboxylic acid Openeye Name: 4-benzamido-1-(2-methyl-3-sulfanyl-propanoyl)piperidine-2-carboxylic acid CAS Name: 4-benzamido-1-(3-mercapto-2-methyl-1-oxopropyl)-2-piperidinecarboxylic acid IUPAC Name: 4-benzamido-1-(2-methyl-3-sulfanylpropanoyl)piperidine-2-carboxylic acid Traditional Name: 4-benzamido-1-(3-mercapto-2-methyl-propanoyl)pipecolinic acid Formula: C17H22N2O4S MolecularWeight: 350.43258

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Descriptors Computed from Structure

Canonical SMILES:

CC(CS)C(=O)N1CCC(CC1C(=O)O)NC(=O)C2=CC=CC=C2

Isomeric SMILES

CC(CS)C(=O)N1CCC(CC1C(=O)O)NC(=O)C2=CC=CC=C2

InChI

InChI=1S/C17H22N2O4S/c1-11(10-24)16(21)19-8-7-13(9-14(19)17(22)23)18-15(20)12-5-3-2-4-6-12/h2-6,11,13-14,24H,7-10H2,1H3,(H,18,20)(H,22,23)