5-[(5-methyl-2-sulfanyl-phenyl)carbonylamino]-2-oxidanyl-benzoic acid

Systemtic Name: 5-[(5-methyl-2-sulfanyl-phenyl)carbonylamino]-2-oxidanyl-benzoic acid Openeye Name: 2-hydroxy-5-[(5-methyl-2-sulfanyl-benzoyl)amino]benzoic acid CAS Name: 2-hydroxy-5-[[(2-mercapto-5-methylphenyl)-oxomethyl]amino]benzoic acid IUPAC Name: 2-hydroxy-5-[(5-methyl-2-sulfanylbenzoyl)amino]benzoic acid Traditional Name: 2-hydroxy-5-[(2-mercapto-5-methyl-benzoyl)amino]benzoic acid Formula: C15H13NO4S MolecularWeight: 303.33302

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)S)C(=O)NC2=CC(=C(C=C2)O)C(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1)S)C(=O)NC2=CC(=C(C=C2)O)C(=O)O

InChI

InChI=1S/C15H13NO4S/c1-8-2-5-13(21)11(6-8)14(18)16-9-3-4-12(17)10(7-9)15(19)20/h2-7,17,21H,1H3,(H,16,18)(H,19,20)