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SMILES: c1(c(cc2c(c1)ncnc2Nc1c(cc(cc1)Br)F)OC)OCC1CCN(CC1)CO Canonical SMILES: OCN1CCC(CC1)COc1cc2ncnc(c2cc1OC)Nc1ccc(cc1F)Br InChI: InChI=1S/C22H24BrFN4O3/c1-30-20-9-16-19(10-21(20)31-11-14-4-6-28(13-29)7-5-14)25-12-26-22(16)27-18-3-2-15(23)8-17(18)24/h2-3,8-10,12,14,29H,4-7,11,13H2,1H3,(H,25,26,27) InChIKey: DOKXHMPUAQBETB-UHFFFAOYSA-N
CBID:171439 http://www.chembase.cn/molecule-171439.html