| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C20H20N2O4S2/c1-27(23,24)14-15-12-22(13-15)28(25,26)19-8-6-16(7-9-19)18-5-4-17-3-2-10-21-20(17)11-18/h2-11,15H,12-14H2,1H3 |
| InChIKey | InChI | 1.06 | LGXSWDBVWIDQTL-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | C[S](=O)(=O)CC1CN(C1)[S](=O)(=O)c2ccc(cc2)c3ccc4cccnc4c3 |
| SMILES | CACTVS | 3.385 | C[S](=O)(=O)CC1CN(C1)[S](=O)(=O)c2ccc(cc2)c3ccc4cccnc4c3 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CS(=O)(=O)CC1CN(C1)S(=O)(=O)c2ccc(cc2)c3ccc4cccnc4c3 |
| SMILES | OpenEye OEToolkits | 2.0.7 | CS(=O)(=O)CC1CN(C1)S(=O)(=O)c2ccc(cc2)c3ccc4cccnc4c3 |
