EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C22H25BrN4O4S2 |
| Net Charge | 0 |
| Average Mass | 553.504 |
| Monoisotopic Mass | 552.05006 |
| SMILES | NS(=O)(=O)c1ccc(CCNC(=O)CCCCCn2c(=S)nc3ccc(Br)cc3c2=O)cc1 |
| InChI | InChI=1S/C22H25BrN4O4S2/c23-16-7-10-19-18(14-16)21(29)27(22(32)26-19)13-3-1-2-4-20(28)25-12-11-15-5-8-17(9-6-15)33(24,30)31/h5-10,14H,1-4,11-13H2,(H,25,28)(H,26,32)(H2,24,30,31) |
| InChIKey | SUMKOABHQLFZSE-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 6-(6-bromo-4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)-N-[2-(4-sulfamoylphenyl)ethyl]hexanamide (CHEBI:113148) is a quinazolines (CHEBI:38530) |
| Manual Xrefs | Databases |
|---|---|
| LSM-24559 | LINCS |