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

Systemtic Name: 2-[[3,5-di(propan-2-yl)-4-sulfanyl-phenyl]amino]-2-oxidanylidene-ethanoic acid Openeye Name: 2-(3,5-diisopropyl-4-sulfanyl-anilino)-2-oxo-acetic acid CAS Name: 2-[4-mercapto-3,5-di(propan-2-yl)anilino]-2-oxoacetic acid IUPAC Name: 2-[3,5-di(propan-2-yl)-4-sulfanylanilino]-2-oxoacetic acid Traditional Name: 2-(3,5-diisopropyl-4-mercapto-anilino)-2-keto-acetic acid Formula: C14H19NO3S MolecularWeight: 281.37056

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=CC(=C1S)C(C)C)NC(=O)C(=O)O

Isomeric SMILES

CC(C)C1=CC(=CC(=C1S)C(C)C)NC(=O)C(=O)O

InChI

InChI=1S/C14H19NO3S/c1-7(2)10-5-9(15-13(16)14(17)18)6-11(8(3)4)12(10)19/h5-8,19H,1-4H3,(H,15,16)(H,17,18)