[[(2S)-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]amino] pyridine-3-carboxylate

Systemtic Name: [[(2S)-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]amino] pyridine-3-carboxylate Openeye Name: [[(1S)-1-formyl-3-methylsulfanyl-propyl]amino] pyridine-3-carboxylate CAS Name: 3-pyridinecarboxylic acid [[(2S)-4-(methylthio)-1-oxobutan-2-yl]amino] ester IUPAC Name: [[(2S)-4-methylsulfanyl-1-oxobutan-2-yl]amino] pyridine-3-carboxylate Traditional Name: nicotinic acid [[(1S)-1-formyl-3-(methylthio)propyl]amino] ester Formula: C11H14N2O3S MolecularWeight: 254.30546

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C=O)NOC(=O)C1=CN=CC=C1

Isomeric SMILES

CSCC[C@@H](C=O)NOC(=O)C1=CN=CC=C1

InChI

InChI=1S/C11H14N2O3S/c1-17-6-4-10(8-14)13-16-11(15)9-3-2-5-12-7-9/h2-3,5,7-8,10,13H,4,6H2,1H3/t10-/m0/s1