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SMILES: C(#N)SCC(=O)c1ccc(cc1)Br Canonical SMILES: N#CSCC(=O)c1ccc(cc1)Br InChI: InChI=1S/C9H6BrNOS/c10-8-3-1-7(2-4-8)9(12)5-13-6-11/h1-4H,5H2 InChIKey: PIXLLQKMZXDTOU-UHFFFAOYSA-N
CBID:44102 http://www.chembase.cn/molecule-44102.html