| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C20H17ClFN5/c21-17-9-14(1-3-18(17)22)26-20-13(11-23)12-25-19-4-2-15(10-16(19)20)27-7-5-24-6-8-27/h1-4,9-10,12,24H,5-8H2,(H,25,26) |
| InChIKey | InChI | 1.06 | GCRQSWUQJQFYBX-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Fc1ccc(Nc2c(cnc3ccc(cc23)N4CCNCC4)C#N)cc1Cl |
| SMILES | CACTVS | 3.385 | Fc1ccc(Nc2c(cnc3ccc(cc23)N4CCNCC4)C#N)cc1Cl |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1cc(c(cc1Nc2c3cc(ccc3ncc2C#N)N4CCNCC4)Cl)F |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1cc(c(cc1Nc2c3cc(ccc3ncc2C#N)N4CCNCC4)Cl)F |
