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SMILES: n1(c(nnc1S)c1ccccc1)C Canonical SMILES: Cn1c(S)nnc1c1ccccc1 InChI: InChI=1S/C9H9N3S/c1-12-8(10-11-9(12)13)7-5-3-2-4-6-7/h2-6H,1H3,(H,11,13) InChIKey: XGLHJEZLNGXEAZ-UHFFFAOYSA-N
CBID:27805 http://www.chembase.cn/molecule-27805.html