提示: 按住Ctrl键可以同时选择多个官能团
SMILES: S1[C@H]2N(C(=C(C1)C[N+]1(CCCC1)C)C(=O)[O-])C(=O)[C@H]2NC(=O)/C(=N\OC)/c1csc(n1)NC(=O)/C(=N\OC)/c1csc(n1)N Canonical SMILES: CO/N=C(/c1csc(n1)NC(=O)/C(=N\OC)/c1csc(n1)N)\C(=O)N[C@@H]1C(=O)N2[C@@H]1SCC(=C2C(=O)[O-])C[N+]1(C)CCCC1 InChI: InChI=1S/C25H29N9O7S3/c1-34(6-4-5-7-34)8-12-9-42-22-17(21(37)33(22)18(12)23(38)39)29-19(35)16(32-41-3)14-11-44-25(28-14)30-20(36)15(31-40-2)13-10-43-24(26)27-13/h10-11,17,22H,4-9H2,1-3H3,(H4-,26,27,28,29,30,35,36,38,39)/b31-15-,32-16-/t17-,22-/m1/s1 InChIKey: KMTSWFKAQYRTIV-LANNWKMSSA-N
CBID:160108 http://www.chembase.cn/molecule-160108.html