1-[4-(hydroxymethyl)-6-methyl-5-oxidanyl-2-(sulfanylmethyl)pyridin-3-yl]ethanone

Systemtic Name: 1-[4-(hydroxymethyl)-6-methyl-5-oxidanyl-2-(sulfanylmethyl)pyridin-3-yl]ethanone Openeye Name: 1-[5-hydroxy-4-(hydroxymethyl)-6-methyl-2-(sulfanylmethyl)-3-pyridyl]ethanone CAS Name: 1-[5-hydroxy-4-(hydroxymethyl)-2-(mercaptomethyl)-6-methyl-3-pyridinyl]ethanone IUPAC Name: 1-[5-hydroxy-4-(hydroxymethyl)-6-methyl-2-(sulfanylmethyl)pyridin-3-yl]ethanone Traditional Name: 1-[5-hydroxy-2-(mercaptomethyl)-6-methyl-4-methylol-3-pyridyl]ethanone Formula: C10H13NO3S MolecularWeight: 227.28012

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C(=N1)CS)C(=O)C)CO)O

Isomeric SMILES

CC1=C(C(=C(C(=N1)CS)C(=O)C)CO)O

InChI

InChI=1S/C10H13NO3S/c1-5-10(14)7(3-12)9(6(2)13)8(4-15)11-5/h12,14-15H,3-4H2,1-2H3