Chem
J-GLOBAL ID：201507010258962463   Nikkaji number：J3.400.910D

Alpelisib

アルペリシブ
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： C19H22F3N5O2S
Molecular formula furigana： C19-H22-F3-N5-O2-S
Molecular weight： 441.470
InChI： InChI=1S/C19H22F3N5O2S/c1-10-14(11-6-7-24-13(9-11)18(2,3)19(20,21)22)30-16(25-10)26-17(29)27-8-4-5-12(27)15(23)28/h6-7,9,12H,4-5,8H2,1-3H3,(H2,23,28)(H,25,26,29)/t12-/m0/s1
InChI key： STUWGJZDJHPWGZ-LBPRGKRZSA-N
SMILES： Cc1nc(NC(=O)N2CCC[C@H]2C(=O)N)sc1c1ccnc(c1)C(C)(C)C(F)(F)F
Systematic name  (3)：
  • (2S)-1-[[5-[2-(2,2,2-トリフルオロ-1,1-ジメチルエチル)-4-ピリジル]-4-メチル-2-チアゾリル]カルバモイル]ピロリジン-2-カルボアミド
  • (2S)-N1-{4-メチル-5-[2-(1,1,1-トリフルオロ-2-メチルプロパン-2-イル)ピリジン-4-イル]-1,3-チアゾール-2-イル}ピロリジン-1,2-ジカルボキサミド
  • (2S)-N1-{4-methyl-5-[2-(1,1,1-trifluoro-2-methylpropan-2-yl)pyridin-4-yl]-1,3-thiazol-2-yl}pyrrolidine-1,2-dicarboxamide
Other name (4)：
  • (2S)-1-[[5-[2-(2,2,2-Trifluoro-1,1-dimethylethyl)-4-pyridyl]-4-methyl-2-thiazolyl]carbamoyl]pyrrolidine-2-carboxamide
  • BYL-719
  • アルペリシブ
  • Alpelisib
CAS registry number： 1217486-61-7
Application (2)：
antitumor action ,  Phosphatidylinositol3-Kinase
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