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SMILES: s1c(nnc1C)SCCC(=O)O Canonical SMILES: Cc1nnc(s1)SCCC(=O)O InChI: InChI=1S/C6H8N2O2S2/c1-4-7-8-6(12-4)11-3-2-5(9)10/h2-3H2,1H3,(H,9,10) InChIKey: BZEBUBGIZUJFKS-UHFFFAOYSA-N
CBID:34436 http://www.chembase.cn/molecule-34436.html