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SMILES: n1(c(nnc1)S)c1cc(Cl)ccc1 Canonical SMILES: Clc1cccc(c1)n1cnnc1S InChI: InChI=1S/C8H6ClN3S/c9-6-2-1-3-7(4-6)12-5-10-11-8(12)13/h1-5H,(H,11,13) InChIKey: BUJPRPNYDPDHJB-UHFFFAOYSA-N
CBID:237386 http://www.chembase.cn/molecule-237386.html