EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C23H24N4O4S |
| Net Charge | 0 |
| Average Mass | 452.536 |
| Monoisotopic Mass | 452.15183 |
| SMILES | COc1ccc(C(=O)NN=Cc2sc(N3CCOCC3)nc2-c2ccccc2)cc1OC |
| InChI | InChI=1S/C23H24N4O4S/c1-29-18-9-8-17(14-19(18)30-2)22(28)26-24-15-20-21(16-6-4-3-5-7-16)25-23(32-20)27-10-12-31-13-11-27/h3-9,14-15H,10-13H2,1-2H3,(H,26,28) |
| InChIKey | IESDEJUEOADSNF-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 3,4-dimethoxy-N-[[2-(4-morpholinyl)-4-phenyl-5-thiazolyl]methylideneamino]benzamide (CHEBI:120584) is a dimethoxybenzene (CHEBI:51681) |
| Manual Xrefs | Databases |
|---|---|
| LSM-32027 | LINCS |