Chem
J-GLOBAL ID：201907013376218181   Nikkaji number：J3.740.503E

1-benzyl-2-(pyridin-4-yl)-5-(trifluoromethyl)-1,3-benzodiazole

1-ベンジル-2-(ピリジン-4-イル)-5-(トリフルオロメチル)-1,3-ベンゾジアゾール
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C20H14F3N3
Molecular formula furigana： C20-H14-F3-N3
Molecular weight： 353.348
InChI： InChI=1S/C20H14F3N3/c21-20(22,23)16-6-7-18-17(12-16)25-19(15-8-10-24-11-9-15)26(18)13-14-4-2-1-3-5-14/h1-12H,13H2
InChI key： FRJSINJKNVFIHN-UHFFFAOYSA-N
SMILES： c12n(c(nc1cc(cc2)C(F)(F)F)c1ccncc1)Cc1ccccc1
Systematic name  (3)：
  • 1-ベンジル-2-(4-ピリジニル)-5-(トリフルオロメチル)-1H-ベンゾイミダゾール
  • 1-ベンジル-2-(ピリジン-4-イル)-5-(トリフルオロメチル)-1H-1,3-ベンゾジアゾール
  • 1-benzyl-2-(pyridin-4-yl)-5-(trifluoromethyl)-1H-1,3-benzodiazole
Other name (2)：
  • 1-ベンジル-2-(ピリジン-4-イル)-5-(トリフルオロメチル)-1,3-ベンゾジアゾール
  • 1-benzyl-2-(pyridin-4-yl)-5-(trifluoromethyl)-1,3-benzodiazole
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