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SMILES: COc1c(Br)nccn1 Canonical SMILES: COc1nccnc1Br InChI: InChI=1S/C5H5BrN2O/c1-9-5-4(6)7-2-3-8-5/h2-3H,1H3 InChIKey: XOTABKNMXIIQMF-UHFFFAOYSA-N
CBID:287612 http://www.chembase.cn/molecule-287612.html