2-[(2-chlorophenyl)methylsulfanyl]-6-(methoxymethyl)-1H-pyrimidin-4-one

Systemtic Name: 2-[(2-chlorophenyl)methylsulfanyl]-6-(methoxymethyl)-1H-pyrimidin-4-one Openeye Name: 2-[(2-chlorophenyl)methylsulfanyl]-6-(methoxymethyl)-1H-pyrimidin-4-one CAS Name: 2-[(2-chlorophenyl)methylthio]-6-(methoxymethyl)-1H-pyrimidin-4-one IUPAC Name: 2-[(2-chlorophenyl)methylsulfanyl]-6-(methoxymethyl)-1H-pyrimidin-4-one Traditional Name: 2-[(2-chlorobenzyl)thio]-6-(methoxymethyl)-1H-pyrimidin-4-one Formula: C13H13ClN2O2S MolecularWeight: 296.77252

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Descriptors Computed from Structure

Canonical SMILES:

COCC1=CC(=O)N=C(N1)SCC2=CC=CC=C2Cl

Isomeric SMILES

COCC1=CC(=O)N=C(N1)SCC2=CC=CC=C2Cl

InChI

InChI=1S/C13H13ClN2O2S/c1-18-7-10-6-12(17)16-13(15-10)19-8-9-4-2-3-5-11(9)14/h2-6H,7-8H2,1H3,(H,15,16,17)