3-(4,6-dimethylpyrimidin-2-yl)sulfanylpropane-1,2-diol

Systemtic Name: 3-(4,6-dimethylpyrimidin-2-yl)sulfanylpropane-1,2-diol Openeye Name: 3-(4,6-dimethylpyrimidin-2-yl)sulfanylpropane-1,2-diol CAS Name: 3-[(4,6-dimethyl-2-pyrimidinyl)thio]propane-1,2-diol IUPAC Name: 3-(4,6-dimethylpyrimidin-2-yl)sulfanylpropane-1,2-diol Traditional Name: 3-[(4,6-dimethylpyrimidin-2-yl)thio]propane-1,2-diol Formula: C9H14N2O2S MolecularWeight: 214.28466

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC(CO)O)C

Isomeric SMILES

CC1=CC(=NC(=N1)SCC(CO)O)C

InChI

InChI=1S/C9H14N2O2S/c1-6-3-7(2)11-9(10-6)14-5-8(13)4-12/h3,8,12-13H,4-5H2,1-2H3