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SMILES: n1cn(c2nccnc2C(=O)O)cc1 Canonical SMILES: OC(=O)c1nccnc1n1cncc1 InChI: InChI=1S/C8H6N4O2/c13-8(14)6-7(11-2-1-10-6)12-4-3-9-5-12/h1-5H,(H,13,14) InChIKey: CRPWLCYSHYRTIA-UHFFFAOYSA-N
CBID:90902 http://www.chembase.cn/molecule-90902.html