methyl 3-[(2-ethanoylsulfanyl-2-methyl-propanoyl)amino]pyridine-2-carboxylate

Systemtic Name: methyl 3-[(2-ethanoylsulfanyl-2-methyl-propanoyl)amino]pyridine-2-carboxylate Openeye Name: methyl 3-[(2-acetylsulfanyl-2-methyl-propanoyl)amino]pyridine-2-carboxylate CAS Name: 3-[[2-(acetylthio)-2-methyl-1-oxopropyl]amino]-2-pyridinecarboxylic acid methyl ester IUPAC Name: methyl 3-[(2-acetylsulfanyl-2-methylpropanoyl)amino]pyridine-2-carboxylate Traditional Name: 3-[[2-(acetylthio)-2-methyl-propanoyl]amino]picolinic acid methyl ester Formula: C13H16N2O4S MolecularWeight: 296.34214

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SC(C)(C)C(=O)NC1=C(N=CC=C1)C(=O)OC

Isomeric SMILES

CC(=O)SC(C)(C)C(=O)NC1=C(N=CC=C1)C(=O)OC

InChI

InChI=1S/C13H16N2O4S/c1-8(16)20-13(2,3)12(18)15-9-6-5-7-14-10(9)11(17)19-4/h5-7H,1-4H3,(H,15,18)