methyl 2-[4-(4-chlorophenyl)-6-methyl-pyrimidin-2-yl]sulfanylethanoate

Systemtic Name: methyl 2-[4-(4-chlorophenyl)-6-methyl-pyrimidin-2-yl]sulfanylethanoate Openeye Name: methyl 2-[4-(4-chlorophenyl)-6-methyl-pyrimidin-2-yl]sulfanylacetate CAS Name: 2-[[4-(4-chlorophenyl)-6-methyl-2-pyrimidinyl]thio]acetic acid methyl ester IUPAC Name: methyl 2-[4-(4-chlorophenyl)-6-methylpyrimidin-2-yl]sulfanylacetate Traditional Name: 2-[[4-(4-chlorophenyl)-6-methyl-pyrimidin-2-yl]thio]acetic acid methyl ester Formula: C14H13ClN2O2S MolecularWeight: 308.78322

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC(=C1)C2=CC=C(C=C2)Cl)SCC(=O)OC

Isomeric SMILES

CC1=NC(=NC(=C1)C2=CC=C(C=C2)Cl)SCC(=O)OC

InChI

InChI=1S/C14H13ClN2O2S/c1-9-7-12(10-3-5-11(15)6-4-10)17-14(16-9)20-8-13(18)19-2/h3-7H,8H2,1-2H3