EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C18H18N4O3S2 |
| Net Charge | 0 |
| Average Mass | 402.501 |
| Monoisotopic Mass | 402.08203 |
| SMILES | CN(C)S(=O)(=O)c1cccc(NC(=O)CSc2ncnc3ccccc23)c1 |
| InChI | InChI=1S/C18H18N4O3S2/c1-22(2)27(24,25)14-7-5-6-13(10-14)21-17(23)11-26-18-15-8-3-4-9-16(15)19-12-20-18/h3-10,12H,11H2,1-2H3,(H,21,23) |
| InChIKey | DJKJNZZSMRGFNJ-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| N-[3-(dimethylsulfamoyl)phenyl]-2-(4-quinazolinylthio)acetamide (CHEBI:121375) is a quinazolines (CHEBI:38530) |
| Manual Xrefs | Databases |
|---|---|
| LSM-32818 | LINCS |