2-[(3,5-dimethyl-4-sulfanyl-phenyl)amino]-2-oxidanylidene-ethanoic acid

Systemtic Name: 2-[(3,5-dimethyl-4-sulfanyl-phenyl)amino]-2-oxidanylidene-ethanoic acid Openeye Name: 2-(3,5-dimethyl-4-sulfanyl-anilino)-2-oxo-acetic acid CAS Name: 2-(4-mercapto-3,5-dimethylanilino)-2-oxoacetic acid IUPAC Name: 2-(3,5-dimethyl-4-sulfanylanilino)-2-oxoacetic acid Traditional Name: 2-keto-2-(4-mercapto-3,5-dimethyl-anilino)acetic acid Formula: C10H11NO3S MolecularWeight: 225.26424

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1S)C)NC(=O)C(=O)O

Isomeric SMILES

CC1=CC(=CC(=C1S)C)NC(=O)C(=O)O

InChI

InChI=1S/C10H11NO3S/c1-5-3-7(4-6(2)8(5)15)11-9(12)10(13)14/h3-4,15H,1-2H3,(H,11,12)(H,13,14)