EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C21H15BrFN3O2S |
| Net Charge | 0 |
| Average Mass | 472.339 |
| Monoisotopic Mass | 471.00524 |
| SMILES | O=C(CSc1nnc(-c2ccc(Br)o2)n1Cc1ccccc1)c1ccccc1F |
| InChI | InChI=1S/C21H15BrFN3O2S/c22-19-11-10-18(28-19)20-24-25-21(26(20)12-14-6-2-1-3-7-14)29-13-17(27)15-8-4-5-9-16(15)23/h1-11H,12-13H2 |
| InChIKey | KBUOQAYFGCGAKV-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 2-[[5-(5-bromo-2-furanyl)-4-(phenylmethyl)-1,2,4-triazol-3-yl]thio]-1-(2-fluorophenyl)ethanone (CHEBI:107377) is a aromatic ketone (CHEBI:76224) |
| Manual Xrefs | Databases |
|---|---|
| LSM-18731 | LINCS |