| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C28H34N10O6S2/c1-43-19-7-11-21(12-8-19)45(39,40)37(17-27-29-33-34-30-27)25-15-16-26(24-6-4-3-5-23(24)25)38(18-28-31-35-36-32-28)46(41,42)22-13-9-20(44-2)10-14-22/h3-16,27-36H,17-18H2,1-2H3 |
| InChIKey | InChI | 1.06 | SLXABHXTDPHHNZ-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | COc1ccc(cc1)[S](=O)(=O)N(CC2NNNN2)c3ccc(N(CC4NNNN4)[S](=O)(=O)c5ccc(OC)cc5)c6ccccc36 |
| SMILES | CACTVS | 3.385 | COc1ccc(cc1)[S](=O)(=O)N(CC2NNNN2)c3ccc(N(CC4NNNN4)[S](=O)(=O)c5ccc(OC)cc5)c6ccccc36 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | COc1ccc(cc1)S(=O)(=O)N(CC2NNNN2)c3ccc(c4c3cccc4)N(CC5NNNN5)S(=O)(=O)c6ccc(cc6)OC |
| SMILES | OpenEye OEToolkits | 2.0.7 | COc1ccc(cc1)S(=O)(=O)N(CC2NNNN2)c3ccc(c4c3cccc4)N(CC5NNNN5)S(=O)(=O)c6ccc(cc6)OC |
