| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=S(=O)(c1cc(c(OC)cc1)Nc2ncc(o2)c4cccc(c3ncccc3)c4)CC |
| SMILES_CANONICAL | CACTVS | 3.341 | CC[S](=O)(=O)c1ccc(OC)c(Nc2oc(cn2)c3cccc(c3)c4ccccn4)c1 |
| SMILES | CACTVS | 3.341 | CC[S](=O)(=O)c1ccc(OC)c(Nc2oc(cn2)c3cccc(c3)c4ccccn4)c1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | CCS(=O)(=O)c1ccc(c(c1)Nc2ncc(o2)c3cccc(c3)c4ccccn4)OC |
| SMILES | OpenEye OEToolkits | 1.5.0 | CCS(=O)(=O)c1ccc(c(c1)Nc2ncc(o2)c3cccc(c3)c4ccccn4)OC |
| InChI | InChI | 1.03 | InChI=1S/C23H21N3O4S/c1-3-31(27,28)18-10-11-21(29-2)20(14-18)26-23-25-15-22(30-23)17-8-6-7-16(13-17)19-9-4-5-12-24-19/h4-15H,3H2,1-2H3,(H,25,26) |
| InChIKey | InChI | 1.03 | HTIZPBXCJPQDEM-UHFFFAOYSA-N |
