3-methyl-2-(pyridin-3-ylcarbonylamino)-3-sulfanyl-butanoic acid hydrochloride

Systemtic Name: 3-methyl-2-(pyridin-3-ylcarbonylamino)-3-sulfanyl-butanoic acid hydrochloride Openeye Name: 3-methyl-2-(pyridine-3-carbonylamino)-3-sulfanyl-butanoic acid hydrochloride CAS Name: 3-mercapto-3-methyl-2-[[oxo(3-pyridinyl)methyl]amino]butanoic acid hydrochloride IUPAC Name: 3-methyl-2-(pyridine-3-carbonylamino)-3-sulfanylbutanoic acid hydrochloride Traditional Name: 3-mercapto-3-methyl-2-nicotinamido-butyric acid hydrochloride Formula: C11H15ClN2O3S MolecularWeight: 290.7664

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(C(=O)O)NC(=O)C1=CN=CC=C1)S.Cl

Isomeric SMILES

CC(C)(C(C(=O)O)NC(=O)C1=CN=CC=C1)S.Cl

InChI

InChI=1S/C11H14N2O3S.ClH/c1-11(2,17)8(10(15)16)13-9(14)7-4-3-5-12-6-7;/h3-6,8,17H,1-2H3,(H,13,14)(H,15,16);1H