EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C25H20FN3O2S |
| Net Charge | 0 |
| Average Mass | 445.519 |
| Monoisotopic Mass | 445.12603 |
| SMILES | O=C(CSc1nc2ccccc2c(=O)n1-c1ccccc1F)Nc1ccc2c(c1)CCC2 |
| InChI | InChI=1S/C25H20FN3O2S/c26-20-9-2-4-11-22(20)29-24(31)19-8-1-3-10-21(19)28-25(29)32-15-23(30)27-18-13-12-16-6-5-7-17(16)14-18/h1-4,8-14H,5-7,15H2,(H,27,30) |
| InChIKey | RHPQXKACBFKHMZ-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| N-(2,3-dihydro-1H-inden-5-yl)-2-[[3-(2-fluorophenyl)-4-oxo-2-quinazolinyl]thio]acetamide (CHEBI:92755) is a quinazolines (CHEBI:38530) |
| Manual Xrefs | Databases |
|---|---|
| LSM-2951 | LINCS |