EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C15H12F3N5O |
| Net Charge | 0 |
| Average Mass | 335.289 |
| Monoisotopic Mass | 335.09939 |
| SMILES | Cc1cc(C)n2nc(=O)c(N=Nc3cccc(C(F)(F)F)c3)c2n1 |
| InChI | InChI=1S/C15H12F3N5O/c1-8-6-9(2)23-13(19-8)12(14(24)22-23)21-20-11-5-3-4-10(7-11)15(16,17)18/h3-7H,1-2H3,(H,22,24) |
| InChIKey | FQVAFGRKZUFQLS-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 5,7-dimethyl-3-[3-(trifluoromethyl)phenyl]azo-1H-pyrazolo[1,5-a]pyrimidin-2-one (CHEBI:119881) is a (trifluoromethyl)benzenes (CHEBI:83565) |
| Manual Xrefs | Databases |
|---|---|
| LSM-31325 | LINCS |