EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C21H23N3O4S |
| Net Charge | 0 |
| Average Mass | 413.499 |
| Monoisotopic Mass | 413.14093 |
| SMILES | CC(=O)c1ccc(N2CCN(S(=O)(=O)c3ccc4c(c3)CCC(=O)N4)CC2)cc1 |
| InChI | InChI=1S/C21H23N3O4S/c1-15(25)16-2-5-18(6-3-16)23-10-12-24(13-11-23)29(27,28)19-7-8-20-17(14-19)4-9-21(26)22-20/h2-3,5-8,14H,4,9-13H2,1H3,(H,22,26) |
| InChIKey | HDPBJXKGFKDUCY-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 6-[[4-(4-acetylphenyl)-1-piperazinyl]sulfonyl]-3,4-dihydro-1H-quinolin-2-one (CHEBI:92904) is a aromatic ketone (CHEBI:76224) |
| Manual Xrefs | Databases |
|---|---|
| LSM-3150 | LINCS |