1,1-diethoxy-2-[2-(hydroxymethyl)-3-methyl-pyridin-4-yl]sulfanyl-ethanol

Systemtic Name: 1,1-diethoxy-2-[2-(hydroxymethyl)-3-methyl-pyridin-4-yl]sulfanyl-ethanol Openeye Name: 1,1-diethoxy-2-[[2-(hydroxymethyl)-3-methyl-4-pyridyl]sulfanyl]ethanol CAS Name: 1,1-diethoxy-2-[[2-(hydroxymethyl)-3-methyl-4-pyridinyl]thio]ethanol IUPAC Name: 1,1-diethoxy-2-[2-(hydroxymethyl)-3-methylpyridin-4-yl]sulfanylethanol Traditional Name: 1,1-diethoxy-2-[(3-methyl-2-methylol-4-pyridyl)thio]ethanol Formula: C13H21NO4S MolecularWeight: 287.37514

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(CSC1=C(C(=NC=C1)CO)C)(O)OCC

Isomeric SMILES

CCOC(CSC1=C(C(=NC=C1)CO)C)(O)OCC

InChI

InChI=1S/C13H21NO4S/c1-4-17-13(16,18-5-2)9-19-12-6-7-14-11(8-15)10(12)3/h6-7,15-16H,4-5,8-9H2,1-3H3