| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | Clc2ccccc2NC(=S)C(C#N)C(=O)Nc1cc(ccc1)C(F)(F)F |
| InChI | InChI | 1.03 | InChI=1S/C17H11ClF3N3OS/c18-13-6-1-2-7-14(13)24-16(26)12(9-22)15(25)23-11-5-3-4-10(8-11)17(19,20)21/h1-8,12H,(H,23,25)(H,24,26)/t12-/m1/s1 |
| InChIKey | InChI | 1.03 | JBTPUMQIJZGWRT-GFCCVEGCSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | FC(F)(F)c1cccc(NC(=O)[C@@H](C#N)C(=S)Nc2ccccc2Cl)c1 |
| SMILES | CACTVS | 3.385 | FC(F)(F)c1cccc(NC(=O)[CH](C#N)C(=S)Nc2ccccc2Cl)c1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.9.2 | c1ccc(c(c1)NC(=S)[C@H](C#N)C(=O)Nc2cccc(c2)C(F)(F)F)Cl |
| SMILES | OpenEye OEToolkits | 1.9.2 | c1ccc(c(c1)NC(=S)C(C#N)C(=O)Nc2cccc(c2)C(F)(F)F)Cl |
