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SMILES: n1(ncnc1)c1ccc(cc1)CBr.Br Canonical SMILES: BrCc1ccc(cc1)n1ncnc1.Br InChI: InChI=1S/C9H8BrN3.BrH/c10-5-8-1-3-9(4-2-8)13-7-11-6-12-13;/h1-4,6-7H,5H2;1H InChIKey: KVFRMZUNDNHLOY-UHFFFAOYSA-N
CBID:101120 http://www.chembase.cn/molecule-101120.html