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SMILES: n1nc(Br)ccc1NC Canonical SMILES: CNc1ccc(nn1)Br InChI: InChI=1S/C5H6BrN3/c1-7-5-3-2-4(6)8-9-5/h2-3H,1H3,(H,7,9) InChIKey: WXAUZVBERHOGOC-UHFFFAOYSA-N
CBID:308969 http://www.chembase.cn/molecule-308969.html