| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 14.52 | CC(C)(C)CC(=O)NC(c1cc2ncccc2cc1)C(=O)NO |
| InChI | InChI | 1.06 | InChI=1S/C17H21N3O3/c1-17(2,3)10-14(21)19-15(16(22)20-23)12-7-6-11-5-4-8-18-13(11)9-12/h4-9,15,23H,10H2,1-3H3,(H,19,21)(H,20,22)/t15-/m1/s1 |
| InChIKey | InChI | 1.06 | SILKEJUPGUNUGQ-OAHLLOKOSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CC(C)(C)CC(=O)N[C@@H](C(=O)NO)c1ccc2cccnc2c1 |
| SMILES | CACTVS | 3.385 | CC(C)(C)CC(=O)N[CH](C(=O)NO)c1ccc2cccnc2c1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 3.1.0.0 | CC(C)(C)CC(=O)N[C@H](c1ccc2cccnc2c1)C(=O)NO |
| SMILES | OpenEye OEToolkits | 3.1.0.0 | CC(C)(C)CC(=O)NC(c1ccc2cccnc2c1)C(=O)NO |
