2-benzamido-3-methylsulfanyl-3-sulfanyl-butanoic acid

Systemtic Name: 2-benzamido-3-methylsulfanyl-3-sulfanyl-butanoic acid Openeye Name: 2-benzamido-3-methylsulfanyl-3-sulfanyl-butanoic acid CAS Name: 2-benzamido-3-mercapto-3-(methylthio)butanoic acid IUPAC Name: 2-benzamido-3-methylsulfanyl-3-sulfanylbutanoic acid Traditional Name: 2-benzamido-3-mercapto-3-(methylthio)butyric acid Formula: C12H15NO3S2 MolecularWeight: 285.3824

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C(=O)O)NC(=O)C1=CC=CC=C1)(S)SC

Isomeric SMILES

CC(C(C(=O)O)NC(=O)C1=CC=CC=C1)(S)SC

InChI

InChI=1S/C12H15NO3S2/c1-12(17,18-2)9(11(15)16)13-10(14)8-6-4-3-5-7-8/h3-7,9,17H,1-2H3,(H,13,14)(H,15,16)