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N-Boc-N-Desmethyl Imatinib

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For Research Use Only | Not For Clinical Use
CATAPS1076199239
CAS1076199-23-9
Structure
IUPAC Nametert-butyl 4-[[4-[[4-methyl-3-[(4-pyridin-3-ylpyrimidin-2-yl)amino]phenyl]carbamoyl]phenyl]methyl]piperazine-1-carboxylate
Molecular Weight579.69
Molecular FormulaC33H37N7O3
Canonical SMILESCc1ccc(NC(=O)c2ccc(CN3CCN(CC3)C(=O)OC(C)(C)C)cc2)cc1Nc4nccc(n4)c5cccnc5
InChIInChI=1S/C33H37N7O3/c1-23-7-12-27(20-29(23)38-31-35-15-13-28(37-31)26-6-5-14-34-21-26)36-30(41)25-10-8-24(9-11-25)22-39-16-18-40(19-17-39)32(42)43-33(2,3)4/h5-15,20-21H,16-19,22H2,1-4H3,(H,36,41)(H,35,37,38)
Accurate Mass579.2958
FormatNeat
SubcategoryEnzyme activators
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