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SMILES: n1c(nc(cc1I)OC)N Canonical SMILES: COc1cc(I)nc(n1)N InChI: InChI=1S/C5H6IN3O/c1-10-4-2-3(6)8-5(7)9-4/h2H,1H3,(H2,7,8,9) InChIKey: OUUIKPWOPKWOHG-UHFFFAOYSA-N
CBID:64254 http://www.chembase.cn/molecule-64254.html