EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C22H20F2N4O3S |
| Net Charge | 0 |
| Average Mass | 458.490 |
| Monoisotopic Mass | 458.12242 |
| SMILES | C=CCOc1ccc(C=NN2C(=O)C(CC(=O)Nc3ccc(F)cc3F)SC2=NC)cc1 |
| InChI | InChI=1S/C22H20F2N4O3S/c1-3-10-31-16-7-4-14(5-8-16)13-26-28-21(30)19(32-22(28)25-2)12-20(29)27-18-9-6-15(23)11-17(18)24/h3-9,11,13,19H,1,10,12H2,2H3,(H,27,29) |
| InChIKey | PIKZZSSQQVXWPF-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| N-(2,4-difluorophenyl)-2-[2-methylimino-4-oxo-3-[(4-prop-2-enoxyphenyl)methylideneamino]-5-thiazolidinyl]acetamide (CHEBI:123198) is a anilide (CHEBI:13248) |
| Manual Xrefs | Databases |
|---|---|
| LSM-34640 | LINCS |