EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C24H24FN5OS |
| Net Charge | 0 |
| Average Mass | 449.555 |
| Monoisotopic Mass | 449.16856 |
| SMILES | Cc1cc(C)cc(NC(=O)CSc2nnc(Cc3cccn3C)n2-c2ccc(F)cc2)c1 |
| InChI | InChI=1S/C24H24FN5OS/c1-16-11-17(2)13-19(12-16)26-23(31)15-32-24-28-27-22(14-21-5-4-10-29(21)3)30(24)20-8-6-18(25)7-9-20/h4-13H,14-15H2,1-3H3,(H,26,31) |
| InChIKey | LYXJGNOOZKYQIK-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| N-(3,5-dimethylphenyl)-2-[[4-(4-fluorophenyl)-5-[(1-methyl-2-pyrrolyl)methyl]-1,2,4-triazol-3-yl]thio]acetamide (CHEBI:109247) is a triazoles (CHEBI:35727) |
| Manual Xrefs | Databases |
|---|---|
| LSM-20644 | LINCS |