| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C(Nc1nnn[NH]1)C1CN(Cc2ccccc12)S(=O)(=O)c1cc(ccc1)C(F)(F)F |
| InChI | InChI | 1.03 | InChI=1S/C18H15F3N6O3S/c19-18(20,21)12-5-3-6-13(8-12)31(29,30)27-9-11-4-1-2-7-14(11)15(10-27)16(28)22-17-23-25-26-24-17/h1-8,15H,9-10H2,(H2,22,23,24,25,26,28)/t15-/m1/s1 |
| InChIKey | InChI | 1.03 | HRYBICGLAWEIFK-OAHLLOKOSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | FC(F)(F)c1cccc(c1)[S](=O)(=O)N2C[C@@H](C(=O)Nc3[nH]nnn3)c4ccccc4C2 |
| SMILES | CACTVS | 3.385 | FC(F)(F)c1cccc(c1)[S](=O)(=O)N2C[CH](C(=O)Nc3[nH]nnn3)c4ccccc4C2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1ccc2c(c1)CN(C[C@H]2C(=O)Nc3[nH]nnn3)S(=O)(=O)c4cccc(c4)C(F)(F)F |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1ccc2c(c1)CN(CC2C(=O)Nc3[nH]nnn3)S(=O)(=O)c4cccc(c4)C(F)(F)F |
