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SMILES: Cn1nc(CCC)c2nc([nH]c(=O)c12)c1cc(ccc1OCC)S(=O)(=O)N1CCN(CC1)C(=O)N1CCN(CC1)S(=O)(=O)c1ccc(OCC)c(c1)c1[nH]c(=O)c2c(n1)c(nn2C)CCC Canonical SMILES: CCCc1nn(c2c1nc([nH]c2=O)c1cc(ccc1OCC)S(=O)(=O)N1CCN(CC1)C(=O)N1CCN(CC1)S(=O)(=O)c1ccc(c(c1)c1nc2c(CCC)nn(c2c(=O)[nH]1)C)OCC)C InChI: InChI=1S/C43H54N12O9S2/c1-7-11-31-35-37(50(5)48-31)41(56)46-39(44-35)29-25-27(13-15-33(29)63-9-3)65(59,60)54-21-17-52(18-22-54)43(58)53-19-23-55(24-20-53)66(61,62)28-14-16-34(64-10-4)30(26-28)40-45-36-32(12-8-2)49-51(6)38(36)42(57)47-40/h13-16,25-26H,7-12,17-24H2,1-6H3,(H,44,46,56)(H,45,47,57) InChIKey: HJOMYDLPAYYXFR-UHFFFAOYSA-N
CBID:128102 http://www.chembase.cn/molecule-128102.html