| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | N#Cc1ccc(cc1Cl)CCNCc2cc3c(cc2)ccc(N)n3 |
| InChI | InChI | 1.03 | InChI=1S/C19H17ClN4/c20-17-9-13(1-4-16(17)11-21)7-8-23-12-14-2-3-15-5-6-19(22)24-18(15)10-14/h1-6,9-10,23H,7-8,12H2,(H2,22,24) |
| InChIKey | InChI | 1.03 | KZMLSFIKJMMRRD-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Nc1ccc2ccc(CNCCc3ccc(C#N)c(Cl)c3)cc2n1 |
| SMILES | CACTVS | 3.385 | Nc1ccc2ccc(CNCCc3ccc(C#N)c(Cl)c3)cc2n1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | c1cc(cc2c1ccc(n2)N)CNCCc3ccc(c(c3)Cl)C#N |
| SMILES | OpenEye OEToolkits | 2.0.6 | c1cc(cc2c1ccc(n2)N)CNCCc3ccc(c(c3)Cl)C#N |
