5AC
Summary
| Name: | 5-amino-1H-imidazole-4-carboxamide |
| Formula: | C4 H6 N4 O |
| Formal charge: | 0 |
| Formula weight: | 126.117 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | 5-amino-1H-imidazole-4-carboxamide |
| OpenEye OEToolkits | 1.5.0 | 5-amino-1H-imidazole-4-carboxamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=C(N)c1ncnc1N |
| SMILES_CANONICAL | CACTVS | 3.341 | NC(=O)c1nc[nH]c1N |
| SMILES | CACTVS | 3.341 | NC(=O)c1nc[nH]c1N |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | c1[nH]c(c(n1)C(=O)N)N |
| SMILES | OpenEye OEToolkits | 1.5.0 | c1[nH]c(c(n1)C(=O)N)N |
| InChI | InChI | 1.03 | InChI=1S/C4H6N4O/c5-3-2(4(6)9)7-1-8-3/h1H,5H2,(H2,6,9)(H,7,8) |
| InChIKey | InChI | 1.03 | DVNYTAVYBRSTGK-UHFFFAOYSA-N |
