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SMILES: s1c(ccc1CC#N)Br Canonical SMILES: Brc1ccc(s1)CC#N InChI: InChI=1S/C6H4BrNS/c7-6-2-1-5(9-6)3-4-8/h1-2H,3H2 InChIKey: ZFTILCZVZSZDLI-UHFFFAOYSA-N
CBID:259256 http://www.chembase.cn/molecule-259256.html