EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C22H16FN5OS2 |
| Net Charge | 0 |
| Average Mass | 449.536 |
| Monoisotopic Mass | 449.07803 |
| SMILES | Fc1ccc(-n2c(Cc3ccccc3)nnc2SCc2nc(-c3cccs3)no2)cc1 |
| InChI | InChI=1S/C22H16FN5OS2/c23-16-8-10-17(11-9-16)28-19(13-15-5-2-1-3-6-15)25-26-22(28)31-14-20-24-21(27-29-20)18-7-4-12-30-18/h1-12H,13-14H2 |
| InChIKey | WKPFOSNUERXNOJ-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 5-[[[4-(4-fluorophenyl)-5-(phenylmethyl)-1,2,4-triazol-3-yl]thio]methyl]-3-thiophen-2-yl-1,2,4-oxadiazole (CHEBI:109292) is a triazoles (CHEBI:35727) |
| Manual Xrefs | Databases |
|---|---|
| LSM-20690 | LINCS |