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SMILES: n1(c(ncc1)CC#N)Cc1ccccc1 Canonical SMILES: N#CCc1nccn1Cc1ccccc1 InChI: InChI=1S/C12H11N3/c13-7-6-12-14-8-9-15(12)10-11-4-2-1-3-5-11/h1-5,8-9H,6,10H2 InChIKey: BMZHQSYXCWLVBE-UHFFFAOYSA-N
CBID:253159 http://www.chembase.cn/molecule-253159.html