| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=C(N(c4cccc(c2nnc1ccc(nn12)c3ccccc3)c4)C)C |
| SMILES_CANONICAL | CACTVS | 3.341 | CN(C(C)=O)c1cccc(c1)c2nnc3ccc(nn23)c4ccccc4 |
| SMILES | CACTVS | 3.341 | CN(C(C)=O)c1cccc(c1)c2nnc3ccc(nn23)c4ccccc4 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | CC(=O)N(C)c1cccc(c1)c2nnc3n2nc(cc3)c4ccccc4 |
| SMILES | OpenEye OEToolkits | 1.5.0 | CC(=O)N(C)c1cccc(c1)c2nnc3n2nc(cc3)c4ccccc4 |
| InChI | InChI | 1.03 | InChI=1S/C20H17N5O/c1-14(26)24(2)17-10-6-9-16(13-17)20-22-21-19-12-11-18(23-25(19)20)15-7-4-3-5-8-15/h3-13H,1-2H3 |
| InChIKey | InChI | 1.03 | ALBWBHNFOJJMCV-UHFFFAOYSA-N |
