| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | n4c3c(cc(OC)c(OCCc1nc2c(cc1)cccc2)c3)cnc4 |
| SMILES_CANONICAL | CACTVS | 3.370 | COc1cc2cncnc2cc1OCCc3ccc4ccccc4n3 |
| SMILES | CACTVS | 3.370 | COc1cc2cncnc2cc1OCCc3ccc4ccccc4n3 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.0 | COc1cc2cncnc2cc1OCCc3ccc4ccccc4n3 |
| SMILES | OpenEye OEToolkits | 1.7.0 | COc1cc2cncnc2cc1OCCc3ccc4ccccc4n3 |
| InChI | InChI | 1.03 | InChI=1S/C20H17N3O2/c1-24-19-10-15-12-21-13-22-18(15)11-20(19)25-9-8-16-7-6-14-4-2-3-5-17(14)23-16/h2-7,10-13H,8-9H2,1H3 |
| InChIKey | InChI | 1.03 | REIGRVDNVZOVDL-UHFFFAOYSA-N |
