Chem
J-GLOBAL ID：201907006065097996   Nikkaji number：J3.740.516G

1-(pyridin-3-ylmethyl)-2-(1H-pyrrol-2-yl)-5-(trifluoromethyl)-1,3-benzodiazole

1-(ピリジン-3-イルメチル)-2-(1H-ピロール-2-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： C18H13F3N4
Molecular formula furigana： C18-H13-F3-N4
Molecular weight： 342.325
InChI： InChI=1S/C18H13F3N4/c19-18(20,21)13-5-6-16-15(9-13)24-17(14-4-2-8-23-14)25(16)11-12-3-1-7-22-10-12/h1-10,23H,11H2
InChI key： ICDNQZTYTUSVLW-UHFFFAOYSA-N
SMILES： c12n(c(nc1cc(cc2)C(F)(F)F)c1[nH]ccc1)Cc1cnccc1
Systematic name  (3)：
  • 1-(3-ピリジニルメチル)-2-(1H-ピロール-2-イル)-5-(トリフルオロメチル)-1H-ベンゾイミダゾール
  • 1-[(ピリジン-3-イル)メチル]-2-(1H-ピロール-2-イル)-5-(トリフルオロメチル)-1H-1,3-ベンゾジアゾール
  • 1-[(pyridin-3-yl)methyl]-2-(1H-pyrrol-2-yl)-5-(trifluoromethyl)-1H-1,3-benzodiazole
Other name (2)：
  • 1-(ピリジン-3-イルメチル)-2-(1H-ピロール-2-イル)-5-(トリフルオロメチル)-1,3-ベンゾジアゾール
  • 1-(pyridin-3-ylmethyl)-2-(1H-pyrrol-2-yl)-5-(trifluoromethyl)-1,3-benzodiazole
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