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SMILES: [nH]1c(nnc1N)c1ccc(cc1)Br Canonical SMILES: Brc1ccc(cc1)c1nnc([nH]1)N InChI: InChI=1S/C8H7BrN4/c9-6-3-1-5(2-4-6)7-11-8(10)13-12-7/h1-4H,(H3,10,11,12,13) InChIKey: VXTCEROZEXTJAB-UHFFFAOYSA-N
CBID:259956 http://www.chembase.cn/molecule-259956.html