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SMILES: s1c(nc(c1)Br)N1CCCCC1 Canonical SMILES: Brc1csc(n1)N1CCCCC1 InChI: InChI=1S/C8H11BrN2S/c9-7-6-12-8(10-7)11-4-2-1-3-5-11/h6H,1-5H2 InChIKey: TXOTYFXRRSJMLF-UHFFFAOYSA-N
CBID:804853 http://www.chembase.cn/molecule-804853.html