EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C23H23F3N6O2S |
| Net Charge | 0 |
| Average Mass | 504.538 |
| Monoisotopic Mass | 504.15553 |
| SMILES | CCOc1ccc2nc(NC(=O)CN3CCC(n4nnc5cc(C(F)(F)F)ccc54)CC3)sc2c1 |
| InChI | InChI=1S/C23H23F3N6O2S/c1-2-34-16-4-5-17-20(12-16)35-22(27-17)28-21(33)13-31-9-7-15(8-10-31)32-19-6-3-14(23(24,25)26)11-18(19)29-30-32/h3-6,11-12,15H,2,7-10,13H2,1H3,(H,27,28,33) |
| InChIKey | PHQQBFKDTXONPB-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-[4-[5-(trifluoromethyl)-1-benzotriazolyl]-1-piperidinyl]acetamide (CHEBI:115121) is a amino acid amide (CHEBI:22475) |
| Manual Xrefs | Databases |
|---|---|
| LSM-26582 | LINCS |