| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C21H19FN4O3/c22-17-12-24-20(11-23)25-21(17)26(8-9-27-16-4-2-1-3-5-16)13-15-6-7-18-19(10-15)29-14-28-18/h1-7,10-12,23H,8-9,13-14H2/b23-11+ |
| InChIKey | InChI | 1.03 | WKKCNOKGPKWFJS-FOKLQQMPSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Fc1cnc(C=N)nc1N(CCOc2ccccc2)Cc3ccc4OCOc4c3 |
| SMILES | CACTVS | 3.385 | Fc1cnc(C=N)nc1N(CCOc2ccccc2)Cc3ccc4OCOc4c3 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | [H]/N=C/c1ncc(c(n1)N(CCOc2ccccc2)Cc3ccc4c(c3)OCO4)F |
| SMILES | OpenEye OEToolkits | 2.0.6 | c1ccc(cc1)OCCN(Cc2ccc3c(c2)OCO3)c4c(cnc(n4)C=N)F |
