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SMILES: C\1(=C\C(=O)OCC)/N(C(=O)CS1)CCBr Canonical SMILES: BrCCN1/C(=C/C(=O)OCC)/SCC1=O InChI: InChI=1S/C9H12BrNO3S/c1-2-14-9(13)5-8-11(4-3-10)7(12)6-15-8/h5H,2-4,6H2,1H3/b8-5- InChIKey: XTXPYSSPMHXYKG-YVMONPNESA-N
CBID:249400 http://www.chembase.cn/molecule-249400.html