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

Systemtic Name: 2-(4,6-dimethoxypyrimidin-2-yl)sulfanylhexanal Openeye Name: 2-(4,6-dimethoxypyrimidin-2-yl)sulfanylhexanal CAS Name: 2-[(4,6-dimethoxy-2-pyrimidinyl)thio]hexanal IUPAC Name: 2-(4,6-dimethoxypyrimidin-2-yl)sulfanylhexanal Traditional Name: 2-[(4,6-dimethoxypyrimidin-2-yl)thio]hexanal Formula: C12H18N2O3S MolecularWeight: 270.34792

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H18N2O3S/c1-4-5-6-9(8-15)18-12-13-10(16-2)7-11(14-12)17-3/h7-9H,4-6H2,1-3H3