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

Systemtic Name: methyl 3-[(2-methyl-3-sulfanyl-propanoyl)amino]pyridine-2-carboxylate Openeye Name: methyl 3-[(2-methyl-3-sulfanyl-propanoyl)amino]pyridine-2-carboxylate CAS Name: 3-[(3-mercapto-2-methyl-1-oxopropyl)amino]-2-pyridinecarboxylic acid methyl ester IUPAC Name: methyl 3-[(2-methyl-3-sulfanylpropanoyl)amino]pyridine-2-carboxylate Traditional Name: 3-[(3-mercapto-2-methyl-propanoyl)amino]picolinic acid methyl ester Formula: C11H14N2O3S MolecularWeight: 254.30546

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H14N2O3S/c1-7(6-17)10(14)13-8-4-3-5-12-9(8)11(15)16-2/h3-5,7,17H,6H2,1-2H3,(H,13,14)