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SMILES: n1(c(nnc1COc1cc(c(cc1)Cl)C)S)CC=C Canonical SMILES: C=CCn1c(COc2ccc(c(c2)C)Cl)nnc1S InChI: InChI=1S/C13H14ClN3OS/c1-3-6-17-12(15-16-13(17)19)8-18-10-4-5-11(14)9(2)7-10/h3-5,7H,1,6,8H2,2H3,(H,16,19) InChIKey: SLULHIPFPXTDPW-UHFFFAOYSA-N
CBID:28000 http://www.chembase.cn/molecule-28000.html