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SMILES: s1c(nnc1C1CCC1)NC(=O)CCl Canonical SMILES: ClCC(=O)Nc1nnc(s1)C1CCC1 InChI: InChI=1S/C8H10ClN3OS/c9-4-6(13)10-8-12-11-7(14-8)5-2-1-3-5/h5H,1-4H2,(H,10,12,13) InChIKey: JTFYPGWANGGREM-UHFFFAOYSA-N
CBID:30650 http://www.chembase.cn/molecule-30650.html