EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C20H20N4O5S2 |
| Net Charge | 0 |
| Average Mass | 460.537 |
| Monoisotopic Mass | 460.08751 |
| SMILES | COc1ccc(NC(=O)CSc2nc(NS(=O)(=O)c3ccc(C)cc3)cc(=O)n2)cc1 |
| InChI | InChI=1S/C20H20N4O5S2/c1-13-3-9-16(10-4-13)31(27,28)24-17-11-18(25)23-20(22-17)30-12-19(26)21-14-5-7-15(29-2)8-6-14/h3-11H,12H2,1-2H3,(H,21,26)(H2,22,23,24,25) |
| InChIKey | NUGRGXXRCSYGGA-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| N-(4-methoxyphenyl)-2-[[6-[(4-methylphenyl)sulfonylamino]-4-oxo-1H-pyrimidin-2-yl]thio]acetamide (CHEBI:108933) is a sulfonamide (CHEBI:35358) |
| Manual Xrefs | Databases |
|---|---|
| LSM-20331 | LINCS |