2-methylsulfanyl-5-[[3-(trifluoromethyl)phenyl]methyl]-1H-pyrimidin-6-one

Systemtic Name: 2-methylsulfanyl-5-[[3-(trifluoromethyl)phenyl]methyl]-1H-pyrimidin-6-one Openeye Name: 2-methylsulfanyl-5-[[3-(trifluoromethyl)phenyl]methyl]-1H-pyrimidin-6-one CAS Name: 2-(methylthio)-5-[[3-(trifluoromethyl)phenyl]methyl]-1H-pyrimidin-6-one IUPAC Name: 2-methylsulfanyl-5-[[3-(trifluoromethyl)phenyl]methyl]-1H-pyrimidin-6-one Traditional Name: 2-(methylthio)-5-[3-(trifluoromethyl)benzyl]-1H-pyrimidin-6-one Formula: C13H11F3N2OS MolecularWeight: 300.29945

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC=C(C(=O)N1)CC2=CC(=CC=C2)C(F)(F)F

Isomeric SMILES

CSC1=NC=C(C(=O)N1)CC2=CC(=CC=C2)C(F)(F)F

InChI

InChI=1S/C13H11F3N2OS/c1-20-12-17-7-9(11(19)18-12)5-8-3-2-4-10(6-8)13(14,15)16/h2-4,6-7H,5H2,1H3,(H,17,18,19)