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

Systemtic Name: 3-methyl-6-propan-2-yl-2-[[4-(trifluoromethyl)phenyl]methylsulfanyl]pyrimidin-4-one Openeye Name: 6-isopropyl-3-methyl-2-[[4-(trifluoromethyl)phenyl]methylsulfanyl]pyrimidin-4-one CAS Name: 3-methyl-6-propan-2-yl-2-[[4-(trifluoromethyl)phenyl]methylthio]-4-pyrimidinone IUPAC Name: 3-methyl-6-propan-2-yl-2-[[4-(trifluoromethyl)phenyl]methylsulfanyl]pyrimidin-4-one Traditional Name: 6-isopropyl-3-methyl-2-[[4-(trifluoromethyl)benzyl]thio]pyrimidin-4-one Formula: C16H17F3N2OS MolecularWeight: 342.37919

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=O)N(C(=N1)SCC2=CC=C(C=C2)C(F)(F)F)C

Isomeric SMILES

CC(C)C1=CC(=O)N(C(=N1)SCC2=CC=C(C=C2)C(F)(F)F)C

InChI

InChI=1S/C16H17F3N2OS/c1-10(2)13-8-14(22)21(3)15(20-13)23-9-11-4-6-12(7-5-11)16(17,18)19/h4-8,10H,9H2,1-3H3