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SMILES: O=c1[nH]c2ncc(Br)nc2[nH]1 Canonical SMILES: Brc1cnc2c(n1)[nH]c(=O)[nH]2 InChI: InChI=1S/C5H3BrN4O/c6-2-1-7-3-4(8-2)10-5(11)9-3/h1H,(H2,7,8,9,10,11) InChIKey: KNHWRTKKDFEAEB-UHFFFAOYSA-N
CBID:291712 http://www.chembase.cn/molecule-291712.html