| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=C(Nc1ccncc1)C2CCC(C(N)C)CC2 |
| SMILES_CANONICAL | CACTVS | 3.341 | C[C@@H](N)[C@H]1CC[C@@H](CC1)C(=O)Nc2ccncc2 |
| SMILES | CACTVS | 3.341 | C[CH](N)[CH]1CC[CH](CC1)C(=O)Nc2ccncc2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | C[C@H](C1CCC(CC1)C(=O)Nc2ccncc2)N |
| SMILES | OpenEye OEToolkits | 1.5.0 | CC(C1CCC(CC1)C(=O)Nc2ccncc2)N |
| InChI | InChI | 1.03 | InChI=1S/C14H21N3O/c1-10(15)11-2-4-12(5-3-11)14(18)17-13-6-8-16-9-7-13/h6-12H,2-5,15H2,1H3,(H,16,17,18)/t10-,11-,12-/m1/s1 |
| InChIKey | InChI | 1.03 | IYOZTVGMEWJPKR-IJLUTSLNSA-N |
