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SMILES: n12c(ncc1Br)ccc(c2)C#N Canonical SMILES: Brc1cnc2n1cc(cc2)C#N InChI: InChI=1S/C8H4BrN3/c9-7-4-11-8-2-1-6(3-10)5-12(7)8/h1-2,4-5H InChIKey: UOQHWNPVNXSDDO-UHFFFAOYSA-N
CBID:42724 http://www.chembase.cn/molecule-42724.html