Chem
J-GLOBAL ID：201607017383412140   Nikkaji number：J3.524.794G

1-(2,3-Dihydro-1H-pyrrolo[2,3-b]pyridine-1-yl)-2-trifluoromethyl-3-phenyl-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-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： C22H24F3N3O3
Molecular formula furigana： C22-H24-F3-N3-O3
Molecular weight： 435.447
InChI： InChI=1S/C22H24F3N3O3/c1-21(2,3)31-20(30)27-17(14-8-5-4-6-9-14)16(22(23,24)25)19(29)28-13-11-15-10-7-12-26-18(15)28/h4-10,12,16-17H,11,13H2,1-3H3,(H,27,30)
InChI key： VCUQJRRPYQHAKG-UHFFFAOYSA-N
SMILES： CC(C)(C)OC(=O)NC(C(C(=O)N1CCc2cccnc12)C(F)(F)F)c1ccccc1
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-フェニル-3-(Boc-アミノ)-1-プロパノン
  • tert-ブチル N-(3-オキソ-1-フェニル-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-(3-oxo-1-phenyl-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-phenyl-3-(Boc-amino)-1-propanone
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