| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | c1(cc(C(F)(F)F)ccc1)CN3C=NC(=C2N=CN=C23)N |
| InChI | InChI | 1.03 | InChI=1S/C13H10F3N5/c14-13(15,16)9-3-1-2-8(4-9)5-21-7-20-11(17)10-12(21)19-6-18-10/h1-4,6-7H,5,17H2 |
| InChIKey | InChI | 1.03 | XBJYKUQVYDSDTN-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Nc1ncn(Cc2cccc(c2)C(F)(F)F)c3ncnc13 |
| SMILES | CACTVS | 3.385 | Nc1ncn(Cc2cccc(c2)C(F)(F)F)c3ncnc13 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1cc(cc(c1)C(F)(F)F)Cn2cnc(c-3ncnc23)N |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1cc(cc(c1)C(F)(F)F)Cn2cnc(c-3ncnc23)N |
