| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | Cn1cc(nc1COc1nc2ccccc2nc1Cl)c1ccccc1 |
| InChI | InChI | 1.03 | InChI=1S/C19H15ClN4O/c1-24-11-16(13-7-3-2-4-8-13)21-17(24)12-25-19-18(20)22-14-9-5-6-10-15(14)23-19/h2-11H,12H2,1H3 |
| InChIKey | InChI | 1.03 | HUEYKHXLAUPAGR-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Cn1cc(nc1COc2nc3ccccc3nc2Cl)c4ccccc4 |
| SMILES | CACTVS | 3.385 | Cn1cc(nc1COc2nc3ccccc3nc2Cl)c4ccccc4 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | Cn1cc(nc1COc2c(nc3ccccc3n2)Cl)c4ccccc4 |
| SMILES | OpenEye OEToolkits | 2.0.7 | Cn1cc(nc1COc2c(nc3ccccc3n2)Cl)c4ccccc4 |
