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SMILES: c1(ccc(cc1)[C@H](C(=O)N[C@@H]1C(=O)N2[C@@H]1SC([C@@H]2C(=O)O)(C)C)N)Br Canonical SMILES: N[C@H](c1ccc(cc1)Br)C(=O)N[C@@H]1C(=O)N2[C@@H]1SC([C@@H]2C(=O)O)(C)C InChI: InChI=1S/C16H18BrN3O4S/c1-16(2)11(15(23)24)20-13(22)10(14(20)25-16)19-12(21)9(18)7-3-5-8(17)6-4-7/h3-6,9-11,14H,18H2,1-2H3,(H,19,21)(H,23,24)/t9-,10-,11+,14-/m1/s1 InChIKey: YHGWQHFZQZNZCJ-NJBDSQKTSA-N
CBID:162746 http://www.chembase.cn/molecule-162746.html