EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C6H6N4OS |
| Net Charge | 0 |
| Average Mass | 182.208 |
| Monoisotopic Mass | 182.02623 |
| SMILES | Nn1c(-c2ccco2)nnc1=S |
| InChI | InChI=1S/C6H6N4OS/c7-10-5(8-9-6(10)12)4-2-1-3-11-4/h1-3H,7H2,(H,9,12) |
| InChIKey | XLYBWYJEEHPZMQ-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 4-amino-3-(2-furanyl)-1H-1,2,4-triazole-5-thione (CHEBI:106055) is a triazoles (CHEBI:35727) |
| Manual Xrefs | Databases |
|---|---|
| LSM-17416 | LINCS |