| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | n1c(N)c3c(c2c1cccc2)n(CC(O)(C)C)c(CNCC)n3 |
| InChI | InChI | 1.03 | InChI=1S/C17H23N5O/c1-4-19-9-13-21-14-15(22(13)10-17(2,3)23)11-7-5-6-8-12(11)20-16(14)18/h5-8,19,23H,4,9-10H2,1-3H3,(H2,18,20) |
| InChIKey | InChI | 1.03 | FHJATBIERQTCTN-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CCNCc1nc2c(N)nc3ccccc3c2n1CC(C)(C)O |
| SMILES | CACTVS | 3.385 | CCNCc1nc2c(N)nc3ccccc3c2n1CC(C)(C)O |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | CCNCc1nc2c(n1CC(C)(C)O)c3ccccc3nc2N |
| SMILES | OpenEye OEToolkits | 2.0.6 | CCNCc1nc2c(n1CC(C)(C)O)c3ccccc3nc2N |
