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SMILES: c12c(c3c(s1)CCCC3)c(=O)[nH]nn2 Canonical SMILES: O=c1[nH]nnc2c1c1CCCCc1s2 InChI: InChI=1S/C9H9N3OS/c13-8-7-5-3-1-2-4-6(5)14-9(7)11-12-10-8/h1-4H2,(H,10,11,13) InChIKey: GTRWBCRNNYLZNQ-UHFFFAOYSA-N
CBID:250470 http://www.chembase.cn/molecule-250470.html