2-(4-chlorophenyl)-2-(4,6-dimethoxypyrimidin-2-yl)sulfanyl-ethanal

Systemtic Name: 2-(4-chlorophenyl)-2-(4,6-dimethoxypyrimidin-2-yl)sulfanyl-ethanal Openeye Name: 2-(4-chlorophenyl)-2-(4,6-dimethoxypyrimidin-2-yl)sulfanyl-acetaldehyde CAS Name: 2-(4-chlorophenyl)-2-[(4,6-dimethoxy-2-pyrimidinyl)thio]acetaldehyde IUPAC Name: 2-(4-chlorophenyl)-2-(4,6-dimethoxypyrimidin-2-yl)sulfanylacetaldehyde Traditional Name: 2-(4-chlorophenyl)-2-[(4,6-dimethoxypyrimidin-2-yl)thio]acetaldehyde Formula: C14H13ClN2O3S MolecularWeight: 324.78262

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=NC(=N1)SC(C=O)C2=CC=C(C=C2)Cl)OC

Isomeric SMILES

COC1=CC(=NC(=N1)SC(C=O)C2=CC=C(C=C2)Cl)OC

InChI

InChI=1S/C14H13ClN2O3S/c1-19-12-7-13(20-2)17-14(16-12)21-11(8-18)9-3-5-10(15)6-4-9/h3-8,11H,1-2H3