Chem
J-GLOBAL ID：201507000424592053   Nikkaji number：J3.339.894H

Decernotinib

デセルノチニブ
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： C18H19F3N6O
Molecular formula furigana： C18-H19-F3-N6-O
Molecular weight： 392.386
InChI： InChI=1S/C18H19F3N6O/c1-3-17(2,16(28)25-10-18(19,20)21)27-13-6-8-23-15(26-13)12-9-24-14-11(12)5-4-7-22-14/h4-9H,3,10H2,1-2H3,(H,22,24)(H,25,28)(H,23,26,27)/t17-/m1/s1
InChI key： ASUGUQWIHMTFJL-QGZVFWFLSA-N
SMILES： CC[C@@](C)(Nc1ccnc(n1)c1c[nH]c2ncccc12)C(=O)NCC(F)(F)F
Systematic name  (3)：
  • (2R)-N-(2,2,2-トリフルオロエチル)-2-メチル-2-[[2-(1H-ピロロ[2,3-b]ピリジン-3-イル)-4-ピリミジニル]アミノ]ブタンアミド
  • (2R)-2-メチル-2-[(2-{1H-ピロロ[2,3-b]ピリジン-3-イル}ピリミジン-4-イル)アミノ]-N-(2,2,2-トリフルオロエチル)ブタンアミド
  • (2R)-2-methyl-2-[(2-{1H-pyrrolo[2,3-b]pyridin-3-yl}pyrimidin-4-yl)amino]-N-(2,2,2-trifluoroethyl)butanamide
Other name (5)：
  • (2R)-N-(2,2,2-Trifluoroethyl)-2-methyl-2-[[2-(1H-pyrrolo[2,3-b]pyridine-3-yl)-4-pyrimidinyl]amino]butanamide
  • デセルノチニブ
  • Decernotinib
  • VX-509
  • VX509
CAS registry number： 944842-54-0
Application (2)：
immunosuppressant ,  non-receptortyrosinekinase
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