EBJ
Summary
| Name: | 1H-1,2,3-triazole-5-thiol |
| Formula: | C2 H3 N3 S |
| Formal charge: | 0 |
| Formula weight: | 101.13 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 1H-1,2,3-triazole-5-thiol |
| OpenEye OEToolkits | 2.0.6 | 1~{H}-1,2,3-triazole-5-thiol |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | Sc1nnnc1 |
| InChI | InChI | 1.03 | InChI=1S/C2H3N3S/c6-2-1-3-5-4-2/h1H,(H2,3,4,5,6) |
| InChIKey | InChI | 1.03 | LLCOQBODWBFTDD-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Sc1[nH]nnc1 |
| SMILES | CACTVS | 3.385 | Sc1[nH]nnc1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | c1c([nH]nn1)S |
| SMILES | OpenEye OEToolkits | 2.0.6 | c1c([nH]nn1)S |
