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SMILES: c1(c(nn(c1)CC=C)N)Br Canonical SMILES: C=CCn1cc(c(n1)N)Br InChI: InChI=1S/C6H8BrN3/c1-2-3-10-4-5(7)6(8)9-10/h2,4H,1,3H2,(H2,8,9) InChIKey: VSTQUXKEIYKSOI-UHFFFAOYSA-N
CBID:247402 http://www.chembase.cn/molecule-247402.html