GLL
Summary
| Name: | GLYCOLURIL |
| Formula: | C4 H6 N4 O2 |
| Formal charge: | 0 |
| Formula weight: | 142.116 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | cis-tetrahydroimidazo[4,5-d]imidazole-2,5(1H,3H)-dione |
| OpenEye OEToolkits | 1.5.0 | 1,3,3a,4,6,6a-hexahydroimidazo[4,5-d]imidazole-2,5-dione |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=C1NC2NC(=O)NC2N1 |
| SMILES_CANONICAL | CACTVS | 3.341 | O=C1N[C@@H]2NC(=O)N[C@@H]2N1 |
| SMILES | CACTVS | 3.341 | O=C1N[CH]2NC(=O)N[CH]2N1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | C12C(NC(=O)N1)NC(=O)N2 |
| SMILES | OpenEye OEToolkits | 1.5.0 | C12C(NC(=O)N1)NC(=O)N2 |
| InChI | InChI | 1.03 | InChI=1S/C4H6N4O2/c9-3-5-1-2(7-3)8-4(10)6-1/h1-2H,(H2,5,7,9)(H2,6,8,10)/t1-,2+ |
| InChIKey | InChI | 1.03 | VPVSTMAPERLKKM-XIXRPRMCSA-N |
