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SMILES: c1(c([nH]nc1C)N)c1ccc(cc1)Br Canonical SMILES: Brc1ccc(cc1)c1c(N)[nH]nc1C InChI: InChI=1S/C10H10BrN3/c1-6-9(10(12)14-13-6)7-2-4-8(11)5-3-7/h2-5H,1H3,(H3,12,13,14) InChIKey: XBGQAVPNQRLZOV-UHFFFAOYSA-N
CBID:28099 http://www.chembase.cn/molecule-28099.html