| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C19H16N6O/c20-18(26)15-5-3-14(4-6-15)16-12-23-25-9-7-17(24-19(16)25)22-11-13-2-1-8-21-10-13/h1-10,12H,11H2,(H2,20,26)(H,22,24) |
| InChIKey | InChI | 1.03 | LMGXQBQAUALFTB-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | NC(=O)c1ccc(cc1)c2cnn3ccc(NCc4cccnc4)nc23 |
| SMILES | CACTVS | 3.385 | NC(=O)c1ccc(cc1)c2cnn3ccc(NCc4cccnc4)nc23 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | c1cc(cnc1)CNc2ccn3c(n2)c(cn3)c4ccc(cc4)C(=O)N |
| SMILES | OpenEye OEToolkits | 2.0.6 | c1cc(cnc1)CNc2ccn3c(n2)c(cn3)c4ccc(cc4)C(=O)N |
