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SMILES: c1(nc2c(n1CC)cccc2)NCc1c(ccc(c1)Br)O Canonical SMILES: CCn1c(NCc2cc(Br)ccc2O)nc2c1cccc2 InChI: InChI=1S/C16H16BrN3O/c1-2-20-14-6-4-3-5-13(14)19-16(20)18-10-11-9-12(17)7-8-15(11)21/h3-9,21H,2,10H2,1H3,(H,18,19) InChIKey: GUVFPFMXZFAHAM-UHFFFAOYSA-N
CBID:311616 http://www.chembase.cn/molecule-311616.html