| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | C1N(C(=O)C)CCc4c1cnc(NC2Cc3c(C2)cccc3)n4 |
| InChI | InChI | 1.03 | InChI=1S/C18H20N4O/c1-12(23)22-7-6-17-15(11-22)10-19-18(21-17)20-16-8-13-4-2-3-5-14(13)9-16/h2-5,10,16H,6-9,11H2,1H3,(H,19,20,21) |
| InChIKey | InChI | 1.03 | YZUQRESBRMOGBQ-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CC(=O)N1CCc2nc(NC3Cc4ccccc4C3)ncc2C1 |
| SMILES | CACTVS | 3.385 | CC(=O)N1CCc2nc(NC3Cc4ccccc4C3)ncc2C1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.5 | CC(=O)N1CCc2c(cnc(n2)NC3Cc4ccccc4C3)C1 |
| SMILES | OpenEye OEToolkits | 2.0.5 | CC(=O)N1CCc2c(cnc(n2)NC3Cc4ccccc4C3)C1 |
