EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C19H22N4O6S |
| Net Charge | 0 |
| Average Mass | 434.474 |
| Monoisotopic Mass | 434.12601 |
| SMILES | CC1CCCN(S(=O)(=O)c2ccc(C(=O)Nc3nnc(C4=COCCO4)o3)cc2)C1 |
| InChI | InChI=1S/C19H22N4O6S/c1-13-3-2-8-23(11-13)30(25,26)15-6-4-14(5-7-15)17(24)20-19-22-21-18(29-19)16-12-27-9-10-28-16/h4-7,12-13H,2-3,8-11H2,1H3,(H,20,22,24) |
| InChIKey | WASWTIOEXMNZOY-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| N-[5-(2,3-dihydro-1,4-dioxin-5-yl)-1,3,4-oxadiazol-2-yl]-4-[(3-methyl-1-piperidinyl)sulfonyl]benzamide (CHEBI:119829) is a sulfonamide (CHEBI:35358) |
| Manual Xrefs | Databases |
|---|---|
| LSM-31273 | LINCS |