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SMILES: n1c(scc1CC(=O)OC)N Canonical SMILES: COC(=O)Cc1csc(n1)N InChI: InChI=1S/C6H8N2O2S/c1-10-5(9)2-4-3-11-6(7)8-4/h3H,2H2,1H3,(H2,7,8) InChIKey: XTQKFBGFHDNUFY-UHFFFAOYSA-N
CBID:42227 http://www.chembase.cn/molecule-42227.html