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SMILES: O=C(c1cnc(SC)nc1Cl)O Canonical SMILES: CSc1ncc(c(n1)Cl)C(=O)O InChI: InChI=1S/C6H5ClN2O2S/c1-12-6-8-2-3(5(10)11)4(7)9-6/h2H,1H3,(H,10,11) InChIKey: MYNMNRVNVCHWIT-UHFFFAOYSA-N
CBID:287875 http://www.chembase.cn/molecule-287875.html