EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C23H21F3N2 |
| Net Charge | 0 |
| Average Mass | 382.429 |
| Monoisotopic Mass | 382.16568 |
| SMILES | FC(F)(F)c1cccc(C2=CCN(CCc3ccc4ccncc4c3)CC2)c1 |
| InChI | InChI=1S/C23H21F3N2/c24-23(25,26)22-3-1-2-20(15-22)19-8-12-28(13-9-19)11-7-17-4-5-18-6-10-27-16-21(18)14-17/h1-6,8,10,14-16H,7,9,11-13H2 |
| InChIKey | ZXXHOPNSTZKWRI-UHFFFAOYSA-N |
| Roles Classification |
|---|
| Application: | antirheumatic drug A drug used to treat rheumatoid arthritis. |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| ssr-150106 (CHEBI:756984) has role antirheumatic drug (CHEBI:35842) |
| ssr-150106 (CHEBI:756984) is a isoquinolines (CHEBI:24922) |
| Synonyms | Source |
|---|---|
| SSR-150106 | ChEMBL |
| SSR150106 | ChEMBL |
| SSR-150106XB | ChEMBL |
| SSR150106XB | ChEMBL |