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SMILES: COc1ccc(Br)nc1N Canonical SMILES: COc1ccc(nc1N)Br InChI: InChI=1S/C6H7BrN2O/c1-10-4-2-3-5(7)9-6(4)8/h2-3H,1H3,(H2,8,9) InChIKey: VGGUXXXEJBQZHL-UHFFFAOYSA-N
CBID:294823 http://www.chembase.cn/molecule-294823.html