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SMILES: n1c(n[nH]c1N)SCc1ccc(Cl)cc1 Canonical SMILES: Clc1ccc(cc1)CSc1n[nH]c(n1)N InChI: InChI=1S/C9H9ClN4S/c10-7-3-1-6(2-4-7)5-15-9-12-8(11)13-14-9/h1-4H,5H2,(H3,11,12,13,14) InChIKey: FCBMSTGDFPBEMI-UHFFFAOYSA-N
CBID:42048 http://www.chembase.cn/molecule-42048.html