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SMILES: O=c1n(C2CC2)c2c([nH]1)cncc2 Canonical SMILES: O=c1[nH]c2c(n1C1CC1)ccnc2 InChI: InChI=1S/C9H9N3O/c13-9-11-7-5-10-4-3-8(7)12(9)6-1-2-6/h3-6H,1-2H2,(H,11,13) InChIKey: JTPBTNNOXCHJDL-UHFFFAOYSA-N
CBID:288251 http://www.chembase.cn/molecule-288251.html