Chem
J-GLOBAL ID：202007004092354737   Nikkaji number：J3.747.338C

IPI-549

2-アミノ-N-[(1S)-1-{8-[2-(1-メチル-1H-ピラゾール-4-イル)エチニル]-1-オキソ-2-フェニル-1,2-ジヒドロイソキノリン-3-イル}エチル]ピラゾロ[1,5-a]ピリミジン-3-カルボキサミド
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： C30H24N8O2
Molecular formula furigana： C30-H24-N8-O2
Molecular weight： 528.576
InChI： InChI=1S/C30H24N8O2/c1-19(34-29(39)26-27(31)35-37-15-7-14-32-28(26)37)24-16-22-9-6-8-21(13-12-20-17-33-36(2)18-20)25(22)30(40)38(24)23-10-4-3-5-11-23/h3-11,14-19H,1-2H3,(H2,31,35)(H,34,39)/t19-/m0/s1
InChI key： XUMALORDVCFWKV-IBGZPJMESA-N
SMILES： O=c1n(c([C@@H](NC(=O)c2c3n(nc2N)cccn3)C)cc2c1c(ccc2)C#Cc1cn(nc1)C)c1ccccc1
Systematic name  (2)：
  • 2-アミノ-N-[(1S)-1-{8-[2-(1-メチル-1H-ピラゾール-4-イル)エチニル]-1-オキソ-2-フェニル-1,2-ジヒドロイソキノリン-3-イル}エチル]ピラゾロ[1,5-a]ピリミジン-3-カルボキサミド
  • 2-amino-N-[(1S)-1-{8-[2-(1-methyl-1H-pyrazol-4-yl)ethynyl]-1-oxo-2-phenyl-1,2-dihydroisoquinolin-3-yl}ethyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
Other name (1)：
  • IPI-549
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