3-(4,6-dimethoxypyrimidin-2-yl)sulfanylpentan-2-one

Systemtic Name: 3-(4,6-dimethoxypyrimidin-2-yl)sulfanylpentan-2-one Openeye Name: 3-(4,6-dimethoxypyrimidin-2-yl)sulfanylpentan-2-one CAS Name: 3-[(4,6-dimethoxy-2-pyrimidinyl)thio]-2-pentanone IUPAC Name: 3-(4,6-dimethoxypyrimidin-2-yl)sulfanylpentan-2-one Traditional Name: 3-[(4,6-dimethoxypyrimidin-2-yl)thio]pentan-2-one Formula: C11H16N2O3S MolecularWeight: 256.32134

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)C)SC1=NC(=CC(=N1)OC)OC

Isomeric SMILES

CCC(C(=O)C)SC1=NC(=CC(=N1)OC)OC

InChI

InChI=1S/C11H16N2O3S/c1-5-8(7(2)14)17-11-12-9(15-3)6-10(13-11)16-4/h6,8H,5H2,1-4H3