| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C21H15F3N4O3S/c1-12-17(11-26)19(16-7-6-13(10-25)8-18(16)32(2,30)31)27-20(29)28(12)15-5-3-4-14(9-15)21(22,23)24/h3-9,19H,1-2H3,(H,27,29)/t19-/m1/s1 |
| InChIKey | InChI | 1.03 | WQASVWJQEKONLG-LJQANCHMSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CC1=C(C#N)[C@H](NC(=O)N1c2cccc(c2)C(F)(F)F)c3ccc(cc3[S](C)(=O)=O)C#N |
| SMILES | CACTVS | 3.385 | CC1=C(C#N)[CH](NC(=O)N1c2cccc(c2)C(F)(F)F)c3ccc(cc3[S](C)(=O)=O)C#N |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | CC1=C([C@H](NC(=O)N1c2cccc(c2)C(F)(F)F)c3ccc(cc3S(=O)(=O)C)C#N)C#N |
| SMILES | OpenEye OEToolkits | 1.7.6 | CC1=C(C(NC(=O)N1c2cccc(c2)C(F)(F)F)c3ccc(cc3S(=O)(=O)C)C#N)C#N |
