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SMILES: c1cc(ccc1[C@@H]1CN2CCSC2=N1)Br.C(=O)(C(=O)O)O Canonical SMILES: OC(=O)C(=O)O.Brc1ccc(cc1)[C@@H]1CN2C(=N1)SCC2 InChI: InChI=1S/C11H11BrN2S.C2H2O4/c12-9-3-1-8(2-4-9)10-7-14-5-6-15-11(14)13-10;3-1(4)2(5)6/h1-4,10H,5-7H2;(H,3,4)(H,5,6)/t10-;/m0./s1 InChIKey: ZULBIBHDIQCNIS-PPHPATTJSA-N
CBID:139065 http://www.chembase.cn/molecule-139065.html