2-[(4-chlorophenyl)methylsulfanyl]-6-(dimethoxymethyl)pyrimidin-4-olate

Systemtic Name: 2-[(4-chlorophenyl)methylsulfanyl]-6-(dimethoxymethyl)pyrimidin-4-olate Openeye Name: 2-[(4-chlorophenyl)methylsulfanyl]-6-(dimethoxymethyl)pyrimidin-4-olate CAS Name: 2-[(4-chlorophenyl)methylthio]-6-(dimethoxymethyl)-4-pyrimidinolate IUPAC Name: 2-[(4-chlorophenyl)methylsulfanyl]-6-(dimethoxymethyl)pyrimidin-4-olate Traditional Name: 2-[(4-chlorobenzyl)thio]-6-(dimethoxymethyl)pyrimidin-4-olate Formula: C14H14ClN2O3S- MolecularWeight: 325.79056

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Descriptors Computed from Structure

Canonical SMILES:

COC(C1=CC(=NC(=N1)SCC2=CC=C(C=C2)Cl)[O-])OC

Isomeric SMILES

COC(C1=CC(=NC(=N1)SCC2=CC=C(C=C2)Cl)[O-])OC

InChI

InChI=1S/C14H15ClN2O3S/c1-19-13(20-2)11-7-12(18)17-14(16-11)21-8-9-3-5-10(15)6-4-9/h3-7,13H,8H2,1-2H3,(H,16,17,18)/p-1