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

Systemtic Name: methyl 5-[(2-methyl-2-sulfanyl-propanoyl)amino]pyridine-3-carboxylate Openeye Name: methyl 5-[(2-methyl-2-sulfanyl-propanoyl)amino]pyridine-3-carboxylate CAS Name: 5-[(2-mercapto-2-methyl-1-oxopropyl)amino]-3-pyridinecarboxylic acid methyl ester IUPAC Name: methyl 5-[(2-methyl-2-sulfanylpropanoyl)amino]pyridine-3-carboxylate Traditional Name: 5-[(2-mercapto-2-methyl-propanoyl)amino]nicotinic acid methyl ester Formula: C11H14N2O3S MolecularWeight: 254.30546

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H14N2O3S/c1-11(2,17)10(15)13-8-4-7(5-12-6-8)9(14)16-3/h4-6,17H,1-3H3,(H,13,15)