| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C1CC2(CCCC2)CC(=O)N1CCCCN1CCN(CC1)c1ncccn1 |
| InChI | InChI | 1.06 | InChI=1S/C21H31N5O2/c27-18-16-21(6-1-2-7-21)17-19(28)26(18)11-4-3-10-24-12-14-25(15-13-24)20-22-8-5-9-23-20/h5,8-9H,1-4,6-7,10-17H2 |
| InChIKey | InChI | 1.06 | QWCRAEMEVRGPNT-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | O=C1CC2(CCCC2)CC(=O)N1CCCCN3CCN(CC3)c4ncccn4 |
| SMILES | CACTVS | 3.385 | O=C1CC2(CCCC2)CC(=O)N1CCCCN3CCN(CC3)c4ncccn4 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1cnc(nc1)N2CCN(CC2)CCCCN3C(=O)CC4(CCCC4)CC3=O |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1cnc(nc1)N2CCN(CC2)CCCCN3C(=O)CC4(CCCC4)CC3=O |
