1-(4-fluorophenyl)-4-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-butan-1-one

Systemtic Name: 1-(4-fluorophenyl)-4-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-butan-1-one Openeye Name: 1-(4-fluorophenyl)-4-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-butan-1-one CAS Name: 1-(4-fluorophenyl)-4-[[4-(trifluoromethyl)-2-pyrimidinyl]thio]-1-butanone IUPAC Name: 1-(4-fluorophenyl)-4-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanylbutan-1-one Traditional Name: 1-(4-fluorophenyl)-4-[[4-(trifluoromethyl)pyrimidin-2-yl]thio]butan-1-one Formula: C15H12F4N2OS MolecularWeight: 344.327193

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)CCCSC2=NC=CC(=N2)C(F)(F)F)F

Isomeric SMILES

C1=CC(=CC=C1C(=O)CCCSC2=NC=CC(=N2)C(F)(F)F)F

InChI

InChI=1S/C15H12F4N2OS/c16-11-5-3-10(4-6-11)12(22)2-1-9-23-14-20-8-7-13(21-14)15(17,18)19/h3-8H,1-2,9H2