| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | n3c2nc(c(c1ccccc1)cc2cnc3N)N4CC=CC4 |
| SMILES_CANONICAL | CACTVS | 3.341 | Nc1ncc2cc(c3ccccc3)c(nc2n1)N4CC=CC4 |
| SMILES | CACTVS | 3.341 | Nc1ncc2cc(c3ccccc3)c(nc2n1)N4CC=CC4 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | c1ccc(cc1)c2cc3cnc(nc3nc2N4CC=CC4)N |
| SMILES | OpenEye OEToolkits | 1.5.0 | c1ccc(cc1)c2cc3cnc(nc3nc2N4CC=CC4)N |
| InChI | InChI | 1.03 | InChI=1S/C17H15N5/c18-17-19-11-13-10-14(12-6-2-1-3-7-12)16(20-15(13)21-17)22-8-4-5-9-22/h1-7,10-11H,8-9H2,(H2,18,19,20,21) |
| InChIKey | InChI | 1.03 | QFWNOFXQNCLFBC-UHFFFAOYSA-N |
