EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C21H22N4O4S |
| Net Charge | 0 |
| Average Mass | 426.498 |
| Monoisotopic Mass | 426.13618 |
| SMILES | O=C(Cn1cnc2ccccc2c1=O)Nc1cccc(S(=O)(=O)N2CCCCC2)c1 |
| InChI | InChI=1S/C21H22N4O4S/c26-20(14-24-15-22-19-10-3-2-9-18(19)21(24)27)23-16-7-6-8-17(13-16)30(28,29)25-11-4-1-5-12-25/h2-3,6-10,13,15H,1,4-5,11-12,14H2,(H,23,26) |
| InChIKey | FDSRSBMERQOBIV-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 2-(4-oxo-3-quinazolinyl)-N-[3-(1-piperidinylsulfonyl)phenyl]acetamide (CHEBI:116452) is a quinazolines (CHEBI:38530) |
| Manual Xrefs | Databases |
|---|---|
| LSM-27906 | LINCS |