| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | n1cncc(c1)CC(Nc3cccc(OC2NC(C2)=O)c3)=O |
| InChI | InChI | 1.03 | InChI=1S/C15H14N4O3/c20-13(4-10-7-16-9-17-8-10)18-11-2-1-3-12(5-11)22-15-6-14(21)19-15/h1-3,5,7-9,15H,4,6H2,(H,18,20)(H,19,21)/t15-/m1/s1 |
| InChIKey | InChI | 1.03 | SGVQMOZIVBYLOT-OAHLLOKOSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | O=C1C[C@H](N1)Oc2cccc(NC(=O)Cc3cncnc3)c2 |
| SMILES | CACTVS | 3.385 | O=C1C[CH](N1)Oc2cccc(NC(=O)Cc3cncnc3)c2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1cc(cc(c1)O[C@@H]2CC(=O)N2)NC(=O)Cc3cncnc3 |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1cc(cc(c1)OC2CC(=O)N2)NC(=O)Cc3cncnc3 |
