| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C(O)CC(C1=NNC=2N=C(NC(=O)C=2C1=O)N)C |
| InChI | InChI | 1.03 | InChI=1S/C10H11N5O4/c1-3(2-4(16)17)6-7(18)5-8(15-14-6)12-10(11)13-9(5)19/h3H,2H2,1H3,(H,16,17)(H4,11,12,13,15,18,19)/t3-/m1/s1 |
| InChIKey | InChI | 1.03 | KXEAQLNQKVKEGT-GSVOUGTGSA-N |
| SMILES_CANONICAL | CACTVS | 3.370 | C[C@H](CC(O)=O)C1=NNC2=C(C(=O)NC(=N2)N)C1=O |
| SMILES | CACTVS | 3.370 | C[CH](CC(O)=O)C1=NNC2=C(C(=O)NC(=N2)N)C1=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | C[C@H](CC(=O)O)C1=NNC2=C(C1=O)C(=O)NC(=N2)N |
| SMILES | OpenEye OEToolkits | 1.7.6 | CC(CC(=O)O)C1=NNC2=C(C1=O)C(=O)NC(=N2)N |
