IWU
Summary
| Name: | 6-bromanyl-3H-[1,2,3]triazolo[4,5-b]pyridine |
| Formula: | C5 H3 Br N4 |
| Formal charge: | 0 |
| Formula weight: | 199.008 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 6-bromanyl-3~{H}-[1,2,3]triazolo[4,5-b]pyridine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C5H3BrN4/c6-3-1-4-5(7-2-3)9-10-8-4/h1-2H,(H,7,8,9,10) |
| InChIKey | InChI | 1.06 | YKWWQNVTTSHHGH-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Brc1cnc2[nH]nnc2c1 |
| SMILES | CACTVS | 3.385 | Brc1cnc2[nH]nnc2c1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1c(cnc2c1nn[nH]2)Br |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1c(cnc2c1nn[nH]2)Br |
