| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 14.52 | O=C(Nc1cc2CNCc2cc1)c1cncc2[NH]ncc12 |
| InChI | InChI | 1.06 | InChI=1S/C15H13N5O/c21-15(13-6-17-8-14-12(13)7-18-20-14)19-11-2-1-9-4-16-5-10(9)3-11/h1-3,6-8,16H,4-5H2,(H,18,20)(H,19,21) |
| InChIKey | InChI | 1.06 | FSWBAJPFWVZQJQ-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | O=C(Nc1ccc2CNCc2c1)c3cncc4[nH]ncc34 |
| SMILES | CACTVS | 3.385 | O=C(Nc1ccc2CNCc2c1)c3cncc4[nH]ncc34 |
| SMILES_CANONICAL | OpenEye OEToolkits | 3.1.0.0 | c1cc2c(cc1NC(=O)c3cncc4c3cn[nH]4)CNC2 |
| SMILES | OpenEye OEToolkits | 3.1.0.0 | c1cc2c(cc1NC(=O)c3cncc4c3cn[nH]4)CNC2 |
