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SMILES: Cc1cnc(c(c1OC)C)C[S@](=O)c1nc2cc(ccc2n1[Mg]n1c2ccc(cc2nc1[S@@](=O)Cc1c(c(c(cn1)C)OC)C)OC)OC.O Canonical SMILES: COc1ccc2c(c1)nc(n2[Mg]n1c(nc2c1ccc(c2)OC)[S@@](=O)Cc1ncc(c(c1C)OC)C)[S@@](=O)Cc1ncc(c(c1C)OC)C.O InChI: InChI=1S/2C17H18N3O3S.Mg.H2O/c2*1-10-8-18-15(11(2)16(10)23-4)9-24(21)17-19-13-6-5-12(22-3)7-14(13)20-17;;/h2*5-8H,9H2,1-4H3;;1H2/q2*-1;+2;/t2*24-;;/m00../s1 InChIKey: LGRFYKXKCZKDLS-DIYDTZFBSA-N
CBID:154001 http://www.chembase.cn/molecule-154001.html