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SMILES: c1(nc(n[nH]1)Br)CC(C)C Canonical SMILES: CC(Cc1[nH]nc(n1)Br)C InChI: InChI=1S/C6H10BrN3/c1-4(2)3-5-8-6(7)10-9-5/h4H,3H2,1-2H3,(H,8,9,10) InChIKey: RJITVBCZEZOLIH-UHFFFAOYSA-N
CBID:57536 http://www.chembase.cn/molecule-57536.html