6-methyl-2-methylsulfanyl-5-[[3-(trifluoromethyl)phenyl]methyl]-1H-pyrimidin-4-one

Systemtic Name: 6-methyl-2-methylsulfanyl-5-[[3-(trifluoromethyl)phenyl]methyl]-1H-pyrimidin-4-one Openeye Name: 6-methyl-2-methylsulfanyl-5-[[3-(trifluoromethyl)phenyl]methyl]-1H-pyrimidin-4-one CAS Name: 6-methyl-2-(methylthio)-5-[[3-(trifluoromethyl)phenyl]methyl]-1H-pyrimidin-4-one IUPAC Name: 6-methyl-2-methylsulfanyl-5-[[3-(trifluoromethyl)phenyl]methyl]-1H-pyrimidin-4-one Traditional Name: 6-methyl-2-(methylthio)-5-[3-(trifluoromethyl)benzyl]-1H-pyrimidin-4-one Formula: C14H13F3N2OS MolecularWeight: 314.32603

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N=C(N1)SC)CC2=CC(=CC=C2)C(F)(F)F

Isomeric SMILES

CC1=C(C(=O)N=C(N1)SC)CC2=CC(=CC=C2)C(F)(F)F

InChI

InChI=1S/C14H13F3N2OS/c1-8-11(12(20)19-13(18-8)21-2)7-9-4-3-5-10(6-9)14(15,16)17/h3-6H,7H2,1-2H3,(H,18,19,20)