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SMILES: CCN(CC)CC.c1cc(ccc1Sc1nc2c(=O)[nH]c(nc2n1[C@H]1[C@@H]([C@H]2[C@H](O1)COP(=S)(O2)O)O)N)Cl Canonical SMILES: O[C@@H]1[C@@H]2OP(=S)(O)OC[C@H]2O[C@H]1n1c(Sc2ccc(cc2)Cl)nc2c1nc(N)[nH]c2=O.CCN(CC)CC InChI: InChI=1S/C16H15ClN5O6PS2.C6H15N/c17-6-1-3-7(4-2-6)31-16-19-9-12(20-15(18)21-13(9)24)22(16)14-10(23)11-8(27-14)5-26-29(25,30)28-11;1-4-7(5-2)6-3/h1-4,8,10-11,14,23H,5H2,(H,25,30)(H3,18,20,21,24);4-6H2,1-3H3/t8-,10-,11-,14-,29?;/m1./s1 InChIKey: KVOYZBYGWGWWTD-OZOPYAHTSA-N
CBID:133852 http://www.chembase.cn/molecule-133852.html