EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C22H24N6O4S |
| Net Charge | 0 |
| Average Mass | 468.539 |
| Monoisotopic Mass | 468.15797 |
| SMILES | CCOCCCNC(=O)c1c(N)n(-c2ccc(S(N)(=O)=O)cc2)c2nc3ccccc3nc12 |
| InChI | InChI=1S/C22H24N6O4S/c1-2-32-13-5-12-25-22(29)18-19-21(27-17-7-4-3-6-16(17)26-19)28(20(18)23)14-8-10-15(11-9-14)33(24,30)31/h3-4,6-11H,2,5,12-13,23H2,1H3,(H,25,29)(H2,24,30,31) |
| InChIKey | ACHPSLMZBQZZJK-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 2-amino-N-(3-ethoxypropyl)-1-(4-sulfamoylphenyl)-3-pyrrolo[3,2-b]quinoxalinecarboxamide (CHEBI:120722) is a pyrroles (CHEBI:26455) |
| Manual Xrefs | Databases |
|---|---|
| LSM-32164 | LINCS |