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SMILES: c1(sccn1)NC(=O)CC#N Canonical SMILES: N#CCC(=O)Nc1nccs1 InChI: InChI=1S/C6H5N3OS/c7-2-1-5(10)9-6-8-3-4-11-6/h3-4H,1H2,(H,8,9,10) InChIKey: ZSPNFPWMLPHDQS-UHFFFAOYSA-N
CBID:36901 http://www.chembase.cn/molecule-36901.html