EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C23H20N2O3S |
| Net Charge | 0 |
| Average Mass | 404.491 |
| Monoisotopic Mass | 404.11946 |
| SMILES | O=C1C(CCSc2cccc(O)c2)C(=O)N(c2ccccc2)N1c1ccccc1 |
| InChI | InChI=1S/C23H20N2O3S/c26-19-12-7-13-20(16-19)29-15-14-21-22(27)24(17-8-3-1-4-9-17)25(23(21)28)18-10-5-2-6-11-18/h1-13,16,21,26H,14-15H2 |
| InChIKey | MFHAYQKXXIUACJ-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 4-{2-[(3-hydroxyphenyl)sulfanyl]ethyl}-1,2-diphenylpyrazolidine-3,5-dione (CHEBI:143294) is a sulfoxide (CHEBI:22063) |