| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | [O-][N+](=O)c2c(Cl)cc(NCc1cnc(nc1)N)c(C(=O)N)c2 |
| SMILES_CANONICAL | CACTVS | 3.370 | NC(=O)c1cc(c(Cl)cc1NCc2cnc(N)nc2)[N+]([O-])=O |
| SMILES | CACTVS | 3.370 | NC(=O)c1cc(c(Cl)cc1NCc2cnc(N)nc2)[N+]([O-])=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.0 | c1c(c(cc(c1[N+](=O)[O-])Cl)NCc2cnc(nc2)N)C(=O)N |
| SMILES | OpenEye OEToolkits | 1.7.0 | c1c(c(cc(c1[N+](=O)[O-])Cl)NCc2cnc(nc2)N)C(=O)N |
| InChI | InChI | 1.03 | InChI=1S/C12H11ClN6O3/c13-8-2-9(7(11(14)20)1-10(8)19(21)22)16-3-6-4-17-12(15)18-5-6/h1-2,4-5,16H,3H2,(H2,14,20)(H2,15,17,18) |
| InChIKey | InChI | 1.03 | JNHRQRICVGMRKT-UHFFFAOYSA-N |
