| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C1C=CN(Cc2ccccc2)N=C1c1ccnn1c1ccccc1 |
| InChI | InChI | 1.03 | InChI=1S/C20H16N4O/c25-19-12-14-23(15-16-7-3-1-4-8-16)22-20(19)18-11-13-21-24(18)17-9-5-2-6-10-17/h1-14H,15H2 |
| InChIKey | InChI | 1.03 | ZSHVSOBTUIHUTA-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | O=C1C=CN(Cc2ccccc2)N=C1c3ccnn3c4ccccc4 |
| SMILES | CACTVS | 3.385 | O=C1C=CN(Cc2ccccc2)N=C1c3ccnn3c4ccccc4 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1ccc(cc1)CN2C=CC(=O)C(=N2)c3ccnn3c4ccccc4 |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1ccc(cc1)CN2C=CC(=O)C(=N2)c3ccnn3c4ccccc4 |
