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SMILES: C(=O)(Cc1ncncc1)c1ccccc1 Canonical SMILES: O=C(c1ccccc1)Cc1ccncn1 InChI: InChI=1S/C12H10N2O/c15-12(10-4-2-1-3-5-10)8-11-6-7-13-9-14-11/h1-7,9H,8H2 InChIKey: BJDUPABHTHYHEX-UHFFFAOYSA-N
CBID:12231 http://www.chembase.cn/molecule-12231.html