N-BOC-N-DESMETHYL IMATINIB

CAS No.
1076199-23-9
CCD No.
CCD04139291
Formula
C33 H37 N7 O3
MolWeight
579.701

Basic Information

Product Name: N-BOC-N-DESMETHYL IMATINIB
CAS: 1076199-23-9
English Synonyms: N-BOC-N-DESMETHYL IMATINIB
MDL Number.: MFCD18382195
H bond acceptor: 10
H bond donor: 2
Smile: Cc1ccc(cc1Nc2nccc(n2)c3cccnc3)NC(=O)c4ccc(cc4)CN5CCN(CC5)C(=O)OC(C)(C)C
InChi: InChI=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)
InChiKey: InChIKey=PNYCXPQYRFQURW-UHFFFAOYSA-N

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