| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=C(NCCN(C)C)c2c1nc3c(nc1ccc2)cccc3Br |
| SMILES_CANONICAL | CACTVS | 3.341 | CN(C)CCNC(=O)c1cccc2nc3cccc(Br)c3nc12 |
| SMILES | CACTVS | 3.341 | CN(C)CCNC(=O)c1cccc2nc3cccc(Br)c3nc12 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | CN(C)CCNC(=O)c1cccc2c1nc3c(n2)cccc3Br |
| SMILES | OpenEye OEToolkits | 1.5.0 | CN(C)CCNC(=O)c1cccc2c1nc3c(n2)cccc3Br |
| InChI | InChI | 1.03 | InChI=1S/C17H17BrN4O/c1-22(2)10-9-19-17(23)11-5-3-7-13-15(11)21-16-12(18)6-4-8-14(16)20-13/h3-8H,9-10H2,1-2H3,(H,19,23) |
| InChIKey | InChI | 1.03 | QCANCQNKYBFYAC-UHFFFAOYSA-N |
