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SMILES: n1(c(nnc1SCC(=O)O)c1ccc(cc1)Cl)CC Canonical SMILES: CCn1c(SCC(=O)O)nnc1c1ccc(cc1)Cl InChI: InChI=1S/C12H12ClN3O2S/c1-2-16-11(8-3-5-9(13)6-4-8)14-15-12(16)19-7-10(17)18/h3-6H,2,7H2,1H3,(H,17,18) InChIKey: HJIJQWOTTRBUEW-UHFFFAOYSA-N
CBID:233771 http://www.chembase.cn/molecule-233771.html