EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C26H31N5O3S |
| Net Charge | 0 |
| Average Mass | 493.633 |
| Monoisotopic Mass | 493.21476 |
| SMILES | CCCOc1ccc(NC(=O)C2CC(=O)N=C(NN=C(C)C=Cc3ccc(N(C)C)cc3)S2)cc1 |
| InChI | InChI=1S/C26H31N5O3S/c1-5-16-34-22-14-10-20(11-15-22)27-25(33)23-17-24(32)28-26(35-23)30-29-18(2)6-7-19-8-12-21(13-9-19)31(3)4/h6-15,23H,5,16-17H2,1-4H3,(H,27,33)(H,28,30,32) |
| InChIKey | IFHKKRVUCWHOFP-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 2-[2-[4-[4-(dimethylamino)phenyl]but-3-en-2-ylidene]hydrazinyl]-4-oxo-N-(4-propoxyphenyl)-5,6-dihydro-1,3-thiazine-6-carboxamide (CHEBI:119905) is a anilide (CHEBI:13248) |
| Manual Xrefs | Databases |
|---|---|
| LSM-31349 | LINCS |