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Ibrutinib Diamide Impurity

Ibrutinib Diamide Impurity

Product Description
CAT No.
ALN-I005045
CAS No.
1917333-91-5
Mol. F.
C28H26N6O3
Mol. Wt.
494.6
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Chemical Name : (R)-8-(1-Acryloylpiperidin-3-yl)-10-(4-phenoxyphenyl)-3,4-dihydropyrazolo[4,3-e]pyrimido[1,2-c]pyrimidin-2(8H)-one
Smiles : O=C(CCN1C=N2)N=C1C3=C2N([C@H](CCC4)CN4C(C=C)=O)N=C3C5=CC=C(OC6=CC=CC=C6)C=C5
Inchi : InChI=1S/C50H48N12O4/c1-2-41(63)59-27-9-11-35(29-59)62-50-44(46(58-62)34-19-23-40(24-20-34)66-38-15-7-4-8-16-38)48(54-32-56-50)52-26-25-42(64)60-28-10-12-36(30-60)61-49-43(47(51)53-31-55-49)45(57-61)33-17-21-39(22-18-33)65-37-13-5-3-6-14-37/h2-8,13-24,31-32,35-36H,1,9-12,25-30H2,(H2,51,53,55)(H,52,54,56)/t35-,36+/m0/s1

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