| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | Clc1cnc(nc1NC2CC2)Nc3ccc(OCCOC)cc3 |
| SMILES_CANONICAL | CACTVS | 3.370 | COCCOc1ccc(Nc2ncc(Cl)c(NC3CC3)n2)cc1 |
| SMILES | CACTVS | 3.370 | COCCOc1ccc(Nc2ncc(Cl)c(NC3CC3)n2)cc1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.0 | COCCOc1ccc(cc1)Nc2ncc(c(n2)NC3CC3)Cl |
| SMILES | OpenEye OEToolkits | 1.7.0 | COCCOc1ccc(cc1)Nc2ncc(c(n2)NC3CC3)Cl |
| InChI | InChI | 1.03 | InChI=1S/C16H19ClN4O2/c1-22-8-9-23-13-6-4-12(5-7-13)20-16-18-10-14(17)15(21-16)19-11-2-3-11/h4-7,10-11H,2-3,8-9H2,1H3,(H2,18,19,20,21) |
| InChIKey | InChI | 1.03 | JFFMERHILPGKFE-UHFFFAOYSA-N |
