2-[4-(4-methylphenyl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-1-phenyl-ethanone

Systemtic Name: 2-[4-(4-methylphenyl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-1-phenyl-ethanone Openeye Name: 1-phenyl-2-[4-(p-tolyl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-ethanone CAS Name: 2-[[4-(4-methylphenyl)-6-(trifluoromethyl)-2-pyrimidinyl]thio]-1-phenylethanone IUPAC Name: 2-[4-(4-methylphenyl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-1-phenylethanone Traditional Name: 1-phenyl-2-[[4-(p-tolyl)-6-(trifluoromethyl)pyrimidin-2-yl]thio]ethanone Formula: C20H15F3N2OS MolecularWeight: 388.40611

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC(=NC(=N2)SCC(=O)C3=CC=CC=C3)C(F)(F)F

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC(=NC(=N2)SCC(=O)C3=CC=CC=C3)C(F)(F)F

InChI

InChI=1S/C20H15F3N2OS/c1-13-7-9-14(10-8-13)16-11-18(20(21,22)23)25-19(24-16)27-12-17(26)15-5-3-2-4-6-15/h2-11H,12H2,1H3