| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | c3(ccc(N2CCN(C(Cc1ccc(cc1)C(C)C)=O)CC2)nn3)C#N |
| InChI | InChI | 1.03 | InChI=1S/C20H23N5O/c1-15(2)17-5-3-16(4-6-17)13-20(26)25-11-9-24(10-12-25)19-8-7-18(14-21)22-23-19/h3-8,15H,9-13H2,1-2H3 |
| InChIKey | InChI | 1.03 | LGWDVWIZDPGCFG-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CC(C)c1ccc(CC(=O)N2CCN(CC2)c3ccc(nn3)C#N)cc1 |
| SMILES | CACTVS | 3.385 | CC(C)c1ccc(CC(=O)N2CCN(CC2)c3ccc(nn3)C#N)cc1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | CC(C)c1ccc(cc1)CC(=O)N2CCN(CC2)c3ccc(nn3)C#N |
| SMILES | OpenEye OEToolkits | 2.0.6 | CC(C)c1ccc(cc1)CC(=O)N2CCN(CC2)c3ccc(nn3)C#N |
