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SMILES: c1(C#N)c(cnc(c1)N)Br Canonical SMILES: N#Cc1cc(N)ncc1Br InChI: InChI=1S/C6H4BrN3/c7-5-3-10-6(9)1-4(5)2-8/h1,3H,(H2,9,10) InChIKey: WEMPYBBWDHFMFG-UHFFFAOYSA-N
CBID:247289 http://www.chembase.cn/molecule-247289.html