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SMILES: c12c([nH]cc2)cc(C#N)cc1Br Canonical SMILES: N#Cc1cc(Br)c2c(c1)[nH]cc2 InChI: InChI=1S/C9H5BrN2/c10-8-3-6(5-11)4-9-7(8)1-2-12-9/h1-4,12H InChIKey: LIXMZLHXLYDHRO-UHFFFAOYSA-N
CBID:244469 http://www.chembase.cn/molecule-244469.html