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

Systemtic Name: 3,6-dimethyl-2-[[3-(trifluoromethyl)phenyl]methylsulfanyl]pyrimidin-4-one Openeye Name: 3,6-dimethyl-2-[[3-(trifluoromethyl)phenyl]methylsulfanyl]pyrimidin-4-one CAS Name: 3,6-dimethyl-2-[[3-(trifluoromethyl)phenyl]methylthio]-4-pyrimidinone IUPAC Name: 3,6-dimethyl-2-[[3-(trifluoromethyl)phenyl]methylsulfanyl]pyrimidin-4-one Traditional Name: 3,6-dimethyl-2-[[3-(trifluoromethyl)benzyl]thio]pyrimidin-4-one Formula: C14H13F3N2OS MolecularWeight: 314.32603

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N(C(=N1)SCC2=CC(=CC=C2)C(F)(F)F)C

Isomeric SMILES

CC1=CC(=O)N(C(=N1)SCC2=CC(=CC=C2)C(F)(F)F)C

InChI

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