| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 14.52 | O=P(O)(O)C(F)(F)c1sc2ccc(cc2c1Br)C(=O)NCc1cccnn1 |
| InChI | InChI | 1.06 | InChI=1S/C15H11BrF2N3O4PS/c16-12-10-6-8(14(22)19-7-9-2-1-5-20-21-9)3-4-11(10)27-13(12)15(17,18)26(23,24)25/h1-6H,7H2,(H,19,22)(H2,23,24,25) |
| InChIKey | InChI | 1.06 | KCQUQDBKMRSDOO-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | O[P](O)(=O)C(F)(F)c1sc2ccc(cc2c1Br)C(=O)NCc3cccnn3 |
| SMILES | CACTVS | 3.385 | O[P](O)(=O)C(F)(F)c1sc2ccc(cc2c1Br)C(=O)NCc3cccnn3 |
| SMILES_CANONICAL | OpenEye OEToolkits | 3.1.0.0 | c1cc(nnc1)CNC(=O)c2ccc3c(c2)c(c(s3)C(F)(F)P(=O)(O)O)Br |
| SMILES | OpenEye OEToolkits | 3.1.0.0 | c1cc(nnc1)CNC(=O)c2ccc3c(c2)c(c(s3)C(F)(F)P(=O)(O)O)Br |
