2-[(2-fluorophenyl)methylsulfanyl]-3-methyl-6-(trifluoromethyl)pyrimidin-4-one

Systemtic Name: 2-[(2-fluorophenyl)methylsulfanyl]-3-methyl-6-(trifluoromethyl)pyrimidin-4-one Openeye Name: 2-[(2-fluorophenyl)methylsulfanyl]-3-methyl-6-(trifluoromethyl)pyrimidin-4-one CAS Name: 2-[(2-fluorophenyl)methylthio]-3-methyl-6-(trifluoromethyl)-4-pyrimidinone IUPAC Name: 2-[(2-fluorophenyl)methylsulfanyl]-3-methyl-6-(trifluoromethyl)pyrimidin-4-one Traditional Name: 2-[(2-fluorobenzyl)thio]-3-methyl-6-(trifluoromethyl)pyrimidin-4-one Formula: C13H10F4N2OS MolecularWeight: 318.289913

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C=C(N=C1SCC2=CC=CC=C2F)C(F)(F)F

Isomeric SMILES

CN1C(=O)C=C(N=C1SCC2=CC=CC=C2F)C(F)(F)F

InChI

InChI=1S/C13H10F4N2OS/c1-19-11(20)6-10(13(15,16)17)18-12(19)21-7-8-4-2-3-5-9(8)14/h2-6H,7H2,1H3