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ibrutinib

PubChem CID 24821094· C25H24N6O2

Molecular formula
C25H24N6O2
Molecular weight
440.5 g/mol
IUPAC name
1-[(3R)-3-[4-amino-3-(4-phenoxyphenyl)pyrazolo[3,4-d]pyrimidin-1-yl]piperidin-1-yl]prop-2-en-1-one
SMILES
C=CC(=O)N1CCCC(C1)N2C3=NC=NC(=C3C(=N2)C4=CC=C(C=C4)OC5=CC=CC=C5)N
InChIKey
XYFPWWZEPKGCCK-GOSISDBHSA-N