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

Systemtic Name: 3-methyl-6-(trifluoromethyl)-2-[[3-(trifluoromethyl)phenyl]methylsulfanyl]pyrimidin-4-one Openeye Name: 3-methyl-6-(trifluoromethyl)-2-[[3-(trifluoromethyl)phenyl]methylsulfanyl]pyrimidin-4-one CAS Name: 3-methyl-6-(trifluoromethyl)-2-[[3-(trifluoromethyl)phenyl]methylthio]-4-pyrimidinone IUPAC Name: 3-methyl-6-(trifluoromethyl)-2-[[3-(trifluoromethyl)phenyl]methylsulfanyl]pyrimidin-4-one Traditional Name: 3-methyl-6-(trifluoromethyl)-2-[[3-(trifluoromethyl)benzyl]thio]pyrimidin-4-one Formula: C14H10F6N2OS MolecularWeight: 368.297419

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C=C(N=C1SCC2=CC(=CC=C2)C(F)(F)F)C(F)(F)F

Isomeric SMILES

CN1C(=O)C=C(N=C1SCC2=CC(=CC=C2)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C14H10F6N2OS/c1-22-11(23)6-10(14(18,19)20)21-12(22)24-7-8-3-2-4-9(5-8)13(15,16)17/h2-6H,7H2,1H3