EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C24H19FN6O2S |
| Net Charge | 0 |
| Average Mass | 474.521 |
| Monoisotopic Mass | 474.12742 |
| SMILES | O=C(CSc1nnc(Cn2nnc3ccccc32)o1)N(Cc1ccc(F)cc1)c1ccccc1 |
| InChI | InChI=1S/C24H19FN6O2S/c25-18-12-10-17(11-13-18)14-30(19-6-2-1-3-7-19)23(32)16-34-24-28-27-22(33-24)15-31-21-9-5-4-8-20(21)26-29-31/h1-13H,14-16H2 |
| InChIKey | LZMWKHMCXZOKLD-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 2-[[5-(1-benzotriazolylmethyl)-1,3,4-oxadiazol-2-yl]thio]-N-[(4-fluorophenyl)methyl]-N-phenylacetamide (CHEBI:123382) is a benzotriazoles (CHEBI:48912) |
| Manual Xrefs | Databases |
|---|---|
| LSM-34824 | LINCS |