| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 14.52 | NC(=O)CC1CCCN(C1)c1ncnc2ccccc12 |
| InChI | InChI | 1.06 | InChI=1S/C15H18N4O/c16-14(20)8-11-4-3-7-19(9-11)15-12-5-1-2-6-13(12)17-10-18-15/h1-2,5-6,10-11H,3-4,7-9H2,(H2,16,20)/t11-/m0/s1 |
| InChIKey | InChI | 1.06 | JUSCUUOSRYPCRL-NSHDSACASA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | NC(=O)C[C@@H]1CCCN(C1)c2ncnc3ccccc23 |
| SMILES | CACTVS | 3.385 | NC(=O)C[CH]1CCCN(C1)c2ncnc3ccccc23 |
| SMILES_CANONICAL | OpenEye OEToolkits | 3.1.0.0 | c1ccc2c(c1)c(ncn2)N3CCC[C@H](C3)CC(=O)N |
| SMILES | OpenEye OEToolkits | 3.1.0.0 | c1ccc2c(c1)c(ncn2)N3CCCC(C3)CC(=O)N |
