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이름: compound A3

IUPAC: tert-butyl N-[[4-[[4-[[5-(6-hydroxynaphthalen-2-yl)pyrazolo[1,5-c]pyrimidin-7-yl]amino]phenyl]carbamoyl]phenyl]methyl]carbamate

SMILES: CC(C)(C)OC(=O)NCc1ccc(C(=O)Nc2ccc(Nc3nc(-c4ccc5cc(O)ccc5c4)cc4ccnn34)cc2)cc1

Canonical SMILES: CC(C)(C)OC(=O)NCC1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)NC3=NC(=CC4=CC=NN43)C5=CC6=C(C=C5)C=C(C=C6)O

분자식: C35H32N6O4

분자량: 600.70

InChIKey: AJVURTVINCDSOY-UHFFFAOYSA-N

InChI: InChI=1S/C35H32N6O4/c1-35(2,3)45-34(44)36-21-22-4-6-23(7-5-22)32(43)38-27-11-13-28(14-12-27)39-33-40-31(20-29-16-17-37-41(29)33)26-9-8-25-19-30(42)15-10-24(25)18-26/h4-20,42H,21H2,1-3H3,(H,36,44)(H,38,43)(H,39,40)

PubChem CID: 136388310 →

동의어

SCHEMBL2212020AJVURTVINCDSOY-UHFFFAOYSA-N(4-{4-[5-(6-Hydroxy-naphthalen-2-yl)-pyrazolo[1,5-c]pyrimidin-7-ylamino]-phenylcarbamoyl}-benzyl)-carbamic acid tert-butyl ester

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