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SMILES: c1(nc(ccn1)Br)SC Canonical SMILES: CSc1nc(Br)ccn1 InChI: InChI=1S/C5H5BrN2S/c1-9-5-7-3-2-4(6)8-5/h2-3H,1H3 InChIKey: TZSQAGYDWPPKPE-UHFFFAOYSA-N
CBID:70869 http://www.chembase.cn/molecule-70869.html