2-[(5-cyano-6-methyl-pyridin-2-yl)carbonylamino]-4-methylsulfanyl-butanoic acid

Systemtic Name: 2-[(5-cyano-6-methyl-pyridin-2-yl)carbonylamino]-4-methylsulfanyl-butanoic acid Openeye Name: 2-[(5-cyano-6-methyl-pyridine-2-carbonyl)amino]-4-methylsulfanyl-butanoic acid CAS Name: 2-[[(5-cyano-6-methyl-2-pyridinyl)-oxomethyl]amino]-4-(methylthio)butanoic acid IUPAC Name: 2-[(5-cyano-6-methylpyridine-2-carbonyl)amino]-4-methylsulfanylbutanoic acid Traditional Name: 2-[(5-cyano-6-methyl-picolinoyl)amino]-4-(methylthio)butyric acid Formula: C13H15N3O3S MolecularWeight: 293.3415

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H15N3O3S/c1-8-9(7-14)3-4-10(15-8)12(17)16-11(13(18)19)5-6-20-2/h3-4,11H,5-6H2,1-2H3,(H,16,17)(H,18,19)