3-ethyl-2-[(4-methylphenyl)methylsulfanyl]-6-(trifluoromethyl)pyrimidin-4-one

Systemtic Name: 3-ethyl-2-[(4-methylphenyl)methylsulfanyl]-6-(trifluoromethyl)pyrimidin-4-one Openeye Name: 3-ethyl-2-(p-tolylmethylsulfanyl)-6-(trifluoromethyl)pyrimidin-4-one CAS Name: 3-ethyl-2-[(4-methylphenyl)methylthio]-6-(trifluoromethyl)-4-pyrimidinone IUPAC Name: 3-ethyl-2-[(4-methylphenyl)methylsulfanyl]-6-(trifluoromethyl)pyrimidin-4-one Traditional Name: 3-ethyl-2-[(4-methylbenzyl)thio]-6-(trifluoromethyl)pyrimidin-4-one Formula: C15H15F3N2OS MolecularWeight: 328.35261

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C=C(N=C1SCC2=CC=C(C=C2)C)C(F)(F)F

Isomeric SMILES

CCN1C(=O)C=C(N=C1SCC2=CC=C(C=C2)C)C(F)(F)F

InChI

InChI=1S/C15H15F3N2OS/c1-3-20-13(21)8-12(15(16,17)18)19-14(20)22-9-11-6-4-10(2)5-7-11/h4-8H,3,9H2,1-2H3