| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | n1c(N)cc(cc1CCc2nc(ccc2)CCc3nc(N)cc(c3)C)C |
| SMILES_CANONICAL | CACTVS | 3.370 | Cc1cc(N)nc(CCc2cccc(CCc3cc(C)cc(N)n3)n2)c1 |
| SMILES | CACTVS | 3.370 | Cc1cc(N)nc(CCc2cccc(CCc3cc(C)cc(N)n3)n2)c1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.0 | Cc1cc(nc(c1)N)CCc2cccc(n2)CCc3cc(cc(n3)N)C |
| SMILES | OpenEye OEToolkits | 1.7.0 | Cc1cc(nc(c1)N)CCc2cccc(n2)CCc3cc(cc(n3)N)C |
| InChI | InChI | 1.03 | InChI=1S/C21H25N5/c1-14-10-18(25-20(22)12-14)8-6-16-4-3-5-17(24-16)7-9-19-11-15(2)13-21(23)26-19/h3-5,10-13H,6-9H2,1-2H3,(H2,22,25)(H2,23,26) |
| InChIKey | InChI | 1.03 | NHAXZADCONDMKK-UHFFFAOYSA-N |
