Chem
J-GLOBAL ID:200907051209323200   Nikkaji number:J902.542A

5-[4-(Trifluoromethoxy)benzyl]-11-(3-methyl-2-butenyl)-9-methoxy-11H-pyrido[2,3-b][1,4]benzodiazepin-6(5H)-one

5-[4-(トリフルオロメトキシ)ベンジル]-11-(3-メチル-2-ブテニル)-9-メトキシ-11H-ピリド[2,3-b][1,4]ベンゾジアゼピン-6(5H)-オン
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: C26H24F3N3O3
Molecular formula furigana: C26-H24-F3-N3-O3
Molecular weight: 483.491
InChI: InChI=1S/C26H24F3N3O3/c1-17(2)12-14-31-23-15-20(34-3)10-11-21(23)25(33)32(22-5-4-13-30-24(22)31)16-18-6-8-19(9-7-18)35-26(27,28)29/h4-13,15H,14,16H2,1-3H3
InChI key: DIYKNEOMKSVKHB-UHFFFAOYSA-N
SMILES: COc1ccc2c(c1)n(CC=C(C)C)c1ncccc1n(Cc1ccc(OC(F)(F)F)cc1)c2=O
Systematic name  (3):
  • 5-[4-(トリフルオロメトキシ)ベンジル]-11-(3-メチル-2-ブテニル)-9-メトキシ-11H-ピリド[2,3-b][1,4]ベンゾジアゼピン-6(5H)-オン
  • 14-メトキシ-2-(3-メチルブタ-2-エン-1-イル)-9-{[4-(トリフルオロメトキシ)フェニル]メチル}-2,4,9-トリアザトリシクロ[9.4.0.03,8]ペンタデカ-1(15),3,5,7,11,13-ヘキサエン-10-オン
  • 14-methoxy-2-(3-methylbut-2-en-1-yl)-9-{[4-(trifluoromethoxy)phenyl]methyl}-2,4,9-triazatricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,11,13-hexaen-10-one
Other name (1):
  • 5-[4-(Trifluoromethoxy)benzyl]-11-(3-methyl-2-butenyl)-9-methoxy-11H-pyrido[2,3-b][1,4]benzodiazepin-6(5H)-one
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