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SMILES: c1(ccc2nc(nc(c2c1)N)Cl)Br Canonical SMILES: Brc1ccc2c(c1)c(N)nc(n2)Cl InChI: InChI=1S/C8H5BrClN3/c9-4-1-2-6-5(3-4)7(11)13-8(10)12-6/h1-3H,(H2,11,12,13) InChIKey: AUTBGOKOHKYWGG-UHFFFAOYSA-N
CBID:812455 http://www.chembase.cn/molecule-812455.html