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SMILES: C\1(=N/c2ccc(cc2)OC)/N(C(=O)CC(S1)C(=O)O)C Canonical SMILES: COc1ccc(cc1)/N=C\1/SC(CC(=O)N1C)C(=O)O InChI: InChI=1S/C13H14N2O4S/c1-15-11(16)7-10(12(17)18)20-13(15)14-8-3-5-9(19-2)6-4-8/h3-6,10H,7H2,1-2H3,(H,17,18)/b14-13+ InChIKey: SHHMYICJNAACAQ-BUHFOSPRSA-N
CBID:11149 http://www.chembase.cn/molecule-11149.html