| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | Fc1ccc(cc1)Sc1nc(nc2nc[NH]c12)N(C)CC |
| InChI | InChI | 1.03 | InChI=1S/C14H14FN5S/c1-3-20(2)14-18-12-11(16-8-17-12)13(19-14)21-10-6-4-9(15)5-7-10/h4-8H,3H2,1-2H3,(H,16,17,18,19) |
| InChIKey | InChI | 1.03 | YHHMOYJBLDDZLY-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CCN(C)c1nc(Sc2ccc(F)cc2)c3[nH]cnc3n1 |
| SMILES | CACTVS | 3.385 | CCN(C)c1nc(Sc2ccc(F)cc2)c3[nH]cnc3n1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CCN(C)c1nc2c(c(n1)Sc3ccc(cc3)F)[nH]cn2 |
| SMILES | OpenEye OEToolkits | 2.0.7 | CCN(C)c1nc2c(c(n1)Sc3ccc(cc3)F)[nH]cn2 |
