| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 14.52 | Fc1cc(F)cc(F)c1Sc1ncnc2[NH]cc(C#N)c21 |
| InChI | InChI | 1.06 | InChI=1S/C13H5F3N4S/c14-7-1-8(15)11(9(16)2-7)21-13-10-6(3-17)4-18-12(10)19-5-20-13/h1-2,4-5H,(H,18,19,20) |
| InChIKey | InChI | 1.06 | TTYZGNACOPHKDR-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Fc1cc(F)c(Sc2ncnc3[nH]cc(C#N)c23)c(F)c1 |
| SMILES | CACTVS | 3.385 | Fc1cc(F)c(Sc2ncnc3[nH]cc(C#N)c23)c(F)c1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 3.1.0.0 | c1c(cc(c(c1F)Sc2c3c(c[nH]c3ncn2)C#N)F)F |
| SMILES | OpenEye OEToolkits | 3.1.0.0 | c1c(cc(c(c1F)Sc2c3c(c[nH]c3ncn2)C#N)F)F |
