EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C22H20N2O3S |
| Net Charge | 0 |
| Average Mass | 392.480 |
| Monoisotopic Mass | 392.11946 |
| SMILES | COc1cc(NS(C)(=O)=O)ccc1Cc1c2ccccc2nc2ccccc12 |
| InChI | InChI=1S/C22H20N2O3S/c1-27-22-14-16(24-28(2,25)26)12-11-15(22)13-19-17-7-3-5-9-20(17)23-21-10-6-4-8-18(19)21/h3-12,14,24H,13H2,1-2H3 |
| InChIKey | JRNUZHHDXNSOMO-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| N-[4-(9-acridinylmethyl)-3-methoxyphenyl]methanesulfonamide (CHEBI:93727) is a acridines (CHEBI:22213) |
| Manual Xrefs | Databases |
|---|---|
| LSM-4221 | LINCS |