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SMILES: c1(cnc2c(c1)ncnc2O)Br Canonical SMILES: Brc1cnc2c(c1)ncnc2O InChI: InChI=1S/C7H4BrN3O/c8-4-1-5-6(9-2-4)7(12)11-3-10-5/h1-3H,(H,10,11,12) InChIKey: NGLZIMDUQCALAS-UHFFFAOYSA-N
CBID:51547 http://www.chembase.cn/molecule-51547.html