EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C12H15FN2O2S |
| Net Charge | 0 |
| Average Mass | 270.329 |
| Monoisotopic Mass | 270.08383 |
| SMILES | O=S1(=O)NC2CCCCCN2c2ccc(F)cc21 |
| InChI | InChI=1S/C12H15FN2O2S/c13-9-5-6-10-11(8-9)18(16,17)14-12-4-2-1-3-7-15(10)12/h5-6,8,12,14H,1-4,7H2 |
| InChIKey | YUXMECOUFJYJTQ-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 3-fluoro-6a,7,8,9,10,11-hexahydro-6H-azepino[2,1-c][1,2,4]benzothiadiazine 5,5-dioxide (CHEBI:113143) is a benzothiadiazine (CHEBI:50265) |
| Manual Xrefs | Databases |
|---|---|
| LSM-24554 | LINCS |