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SMILES: n1nc(n(c1C1CCCCC1)C)SCC(=O)O Canonical SMILES: OC(=O)CSc1nnc(n1C)C1CCCCC1 InChI: InChI=1S/C11H17N3O2S/c1-14-10(8-5-3-2-4-6-8)12-13-11(14)17-7-9(15)16/h8H,2-7H2,1H3,(H,15,16) InChIKey: BNHIXPXOCQCHTR-UHFFFAOYSA-N
CBID:10920 http://www.chembase.cn/molecule-10920.html