| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | c31nc(ccc1ccc(CNCCc2cc(c(C#N)cc2)C)c3)N |
| InChI | InChI | 1.03 | InChI=1S/C20H20N4/c1-14-10-15(2-5-18(14)12-21)8-9-23-13-16-3-4-17-6-7-20(22)24-19(17)11-16/h2-7,10-11,23H,8-9,13H2,1H3,(H2,22,24) |
| InChIKey | InChI | 1.03 | OFELXUWNGBXCPK-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Cc1cc(CCNCc2ccc3ccc(N)nc3c2)ccc1C#N |
| SMILES | CACTVS | 3.385 | Cc1cc(CCNCc2ccc3ccc(N)nc3c2)ccc1C#N |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | Cc1cc(ccc1C#N)CCNCc2ccc3ccc(nc3c2)N |
| SMILES | OpenEye OEToolkits | 2.0.6 | Cc1cc(ccc1C#N)CCNCc2ccc3ccc(nc3c2)N |
