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SMILES: Cc1cc(cnc1N)Cl.Cc1cc(cnc1N)Cl.O Canonical SMILES: Clc1cnc(c(c1)C)N.Clc1cnc(c(c1)C)N.O InChI: InChI=1S/2C6H7ClN2.H2O/c2*1-4-2-5(7)3-9-6(4)8;/h2*2-3H,1H3,(H2,8,9);1H2 InChIKey: XUNMRTSHBBFPTI-UHFFFAOYSA-N
CBID:140660 http://www.chembase.cn/molecule-140660.html