2-(4,6-dimethoxypyrimidin-2-yl)sulfanylethanenitrile

Systemtic Name: 2-(4,6-dimethoxypyrimidin-2-yl)sulfanylethanenitrile Openeye Name: 2-(4,6-dimethoxypyrimidin-2-yl)sulfanylacetonitrile CAS Name: 2-[(4,6-dimethoxy-2-pyrimidinyl)thio]acetonitrile IUPAC Name: 2-(4,6-dimethoxypyrimidin-2-yl)sulfanylacetonitrile Traditional Name: 2-[(4,6-dimethoxypyrimidin-2-yl)thio]acetonitrile Formula: C8H9N3O2S MolecularWeight: 211.24096

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=NC(=N1)SCC#N)OC

Isomeric SMILES

COC1=CC(=NC(=N1)SCC#N)OC

InChI

InChI=1S/C8H9N3O2S/c1-12-6-5-7(13-2)11-8(10-6)14-4-3-9/h5H,4H2,1-2H3