| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | N#Cc1c(Cl)ncnc1Nc1cc2CC(=O)Nc2cc1 |
| InChI | InChI | 1.06 | InChI=1S/C13H8ClN5O/c14-12-9(5-15)13(17-6-16-12)18-8-1-2-10-7(3-8)4-11(20)19-10/h1-3,6H,4H2,(H,19,20)(H,16,17,18) |
| InChIKey | InChI | 1.06 | NYUGSENNHNQLPG-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Clc1ncnc(Nc2ccc3NC(=O)Cc3c2)c1C#N |
| SMILES | CACTVS | 3.385 | Clc1ncnc(Nc2ccc3NC(=O)Cc3c2)c1C#N |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1cc2c(cc1Nc3c(c(ncn3)Cl)C#N)CC(=O)N2 |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1cc2c(cc1Nc3c(c(ncn3)Cl)C#N)CC(=O)N2 |
