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SMILES: n1(c(nc2c(c1=O)cccc2)S)CCCC Canonical SMILES: CCCCn1c(S)nc2c(c1=O)cccc2 InChI: InChI=1S/C12H14N2OS/c1-2-3-8-14-11(15)9-6-4-5-7-10(9)13-12(14)16/h4-7H,2-3,8H2,1H3,(H,13,16) InChIKey: YIMVQTWMNLKAPM-UHFFFAOYSA-N
CBID:230106 http://www.chembase.cn/molecule-230106.html