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SMILES: c1c(cnc(c1Br)Cl)C#N Canonical SMILES: N#Cc1cnc(c(c1)Br)Cl InChI: InChI=1S/C6H2BrClN2/c7-5-1-4(2-9)3-10-6(5)8/h1,3H InChIKey: CYXYTFFWGHLPJE-UHFFFAOYSA-N
CBID:44009 http://www.chembase.cn/molecule-44009.html