Chem
J-GLOBAL ID：201607002865077112   Nikkaji number：J3.524.799H

1-(2,3-Dihydro-1H-pyrrolo[2,3-b]pyridine-1-yl)-2-trifluoromethyl-3-(3-vinylphenyl)-3-(Boc-amino)-1-propanone

1-(2,3-ジヒドロ-1H-ピロロ[2,3-b]ピリジン-1-イル)-2-トリフルオロメチル-3-(3-ビニルフェニル)-3-(Boc-アミノ)-1-プロパノン
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： C24H26F3N3O3
Molecular formula furigana： C24-H26-F3-N3-O3
Molecular weight： 461.485
InChI： InChI=1S/C24H26F3N3O3/c1-5-15-8-6-9-17(14-15)19(29-22(32)33-23(2,3)4)18(24(25,26)27)21(31)30-13-11-16-10-7-12-28-20(16)30/h5-10,12,14,18-19H,1,11,13H2,2-4H3,(H,29,32)
InChI key： JNQSJTNUWPAFFQ-UHFFFAOYSA-N
SMILES： CC(C)(C)OC(=O)NC(C(C(=O)N1CCc2cccnc12)C(F)(F)F)c1cccc(C=C)c1
Systematic name  (3)：
  • 1-(2,3-ジヒドロ-1H-ピロロ[2,3-b]ピリジン-1-イル)-2-トリフルオロメチル-3-(3-ビニルフェニル)-3-(Boc-アミノ)-1-プロパノン
  • tert-ブチル N-[1-(3-エテニルフェニル)-3-オキソ-3-{1H,2H,3H-ピロロ[2,3-b]ピリジン-1-イル}-2-(トリフルオロメチル)プロピル]カルバマート
  • tert-butyl N-[1-(3-ethenylphenyl)-3-oxo-3-{1H,2H,3H-pyrrolo[2,3-b]pyridin-1-yl}-2-(trifluoromethyl)propyl]carbamate
Other name (1)：
  • 1-(2,3-Dihydro-1H-pyrrolo[2,3-b]pyridine-1-yl)-2-trifluoromethyl-3-(3-vinylphenyl)-3-(Boc-amino)-1-propanone
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