2-[(4,6-dimethyl-2-oxidanylidene-1H-pyridin-3-yl)carbonylamino]-4-methylsulfanyl-butanoic acid

Systemtic Name: 2-[(4,6-dimethyl-2-oxidanylidene-1H-pyridin-3-yl)carbonylamino]-4-methylsulfanyl-butanoic acid Openeye Name: 2-[(4,6-dimethyl-2-oxo-1H-pyridine-3-carbonyl)amino]-4-methylsulfanyl-butanoic acid CAS Name: 2-[[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)-oxomethyl]amino]-4-(methylthio)butanoic acid IUPAC Name: 2-[(4,6-dimethyl-2-oxo-1H-pyridine-3-carbonyl)amino]-4-methylsulfanylbutanoic acid Traditional Name: 2-[(2-keto-4,6-dimethyl-1H-pyridine-3-carbonyl)amino]-4-(methylthio)butyric acid Formula: C13H18N2O4S MolecularWeight: 298.35802

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=O)N1)C(=O)NC(CCSC)C(=O)O)C

Isomeric SMILES

CC1=CC(=C(C(=O)N1)C(=O)NC(CCSC)C(=O)O)C

InChI

InChI=1S/C13H18N2O4S/c1-7-6-8(2)14-11(16)10(7)12(17)15-9(13(18)19)4-5-20-3/h6,9H,4-5H2,1-3H3,(H,14,16)(H,15,17)(H,18,19)