methyl 5-[(3-ethanoylsulfanyl-2-methyl-propanoyl)amino]pyridine-2-carboxylate

Systemtic Name: methyl 5-[(3-ethanoylsulfanyl-2-methyl-propanoyl)amino]pyridine-2-carboxylate Openeye Name: methyl 5-[(3-acetylsulfanyl-2-methyl-propanoyl)amino]pyridine-2-carboxylate CAS Name: 5-[[3-(acetylthio)-2-methyl-1-oxopropyl]amino]-2-pyridinecarboxylic acid methyl ester IUPAC Name: methyl 5-[(3-acetylsulfanyl-2-methylpropanoyl)amino]pyridine-2-carboxylate Traditional Name: 5-[[3-(acetylthio)-2-methyl-propanoyl]amino]picolinic acid methyl ester Formula: C13H16N2O4S MolecularWeight: 296.34214

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Descriptors Computed from Structure

Canonical SMILES:

CC(CSC(=O)C)C(=O)NC1=CN=C(C=C1)C(=O)OC

Isomeric SMILES

CC(CSC(=O)C)C(=O)NC1=CN=C(C=C1)C(=O)OC

InChI

InChI=1S/C13H16N2O4S/c1-8(7-20-9(2)16)12(17)15-10-4-5-11(14-6-10)13(18)19-3/h4-6,8H,7H2,1-3H3,(H,15,17)