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SMILES: c1([nH]c(nn1)N)c1c(Br)cccc1 Canonical SMILES: Brc1ccccc1c1nnc([nH]1)N InChI: InChI=1S/C8H7BrN4/c9-6-4-2-1-3-5(6)7-11-8(10)13-12-7/h1-4H,(H3,10,11,12,13) InChIKey: CXRHBUWCLZAXAC-UHFFFAOYSA-N
CBID:250402 http://www.chembase.cn/molecule-250402.html