| 種別 | プログラム | バージョン | 表記 |
| InChI | InChI | 1.03 | InChI=1S/C20H20F3N3O2/c1-11(13-6-5-7-14(8-13)20(21,22)23)24-19-15-9-17(27-3)18(28-4)10-16(15)25-12(2)26-19/h5-11H,1-4H3,(H,24,25,26)/t11-/m1/s1 |
| InChIKey | InChI | 1.03 | UWEJNKMEGIGAGY-LLVKDONJSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | COc1cc2nc(C)nc(N[C@H](C)c3cccc(c3)C(F)(F)F)c2cc1OC |
| SMILES | CACTVS | 3.385 | COc1cc2nc(C)nc(N[CH](C)c3cccc(c3)C(F)(F)F)c2cc1OC |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | Cc1nc2cc(c(cc2c(n1)N[C@H](C)c3cccc(c3)C(F)(F)F)OC)OC |
| SMILES | OpenEye OEToolkits | 2.0.7 | Cc1nc2cc(c(cc2c(n1)NC(C)c3cccc(c3)C(F)(F)F)OC)OC |
