3TR
Summary
| Name: | 3-AMINO-1,2,4-TRIAZOLE |
| Synonyms: | AMITROLE |
| Formula: | C2 H4 N4 |
| Formal charge: | 0 |
| Formula weight: | 84.08 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | 1H-1,2,4-triazol-3-amine |
| OpenEye OEToolkits | 1.5.0 | 1H-1,2,4-triazol-3-amine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | n1c(nnc1)N |
| SMILES_CANONICAL | CACTVS | 3.341 | Nc1n[nH]cn1 |
| SMILES | CACTVS | 3.341 | Nc1n[nH]cn1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | c1[nH]nc(n1)N |
| SMILES | OpenEye OEToolkits | 1.5.0 | c1[nH]nc(n1)N |
| InChI | InChI | 1.03 | InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6) |
| InChIKey | InChI | 1.03 | KLSJWNVTNUYHDU-UHFFFAOYSA-N |
