EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C18H14N2O4S2 |
| Net Charge | 0 |
| Average Mass | 386.454 |
| Monoisotopic Mass | 386.03950 |
| SMILES | CS(=O)(=O)C(C#N)=Cc1cccn1S(=O)(=O)c1cccc2ccccc12 |
| InChI | InChI=1S/C18H14N2O4S2/c1-25(21,22)16(13-19)12-15-8-5-11-20(15)26(23,24)18-10-4-7-14-6-2-3-9-17(14)18/h2-12H,1H3 |
| InChIKey | NSFRRADKFRJNDA-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| LSM-3632 (CHEBI:93281) is a naphthalenes (CHEBI:25477) |
| LSM-3632 (CHEBI:93281) is a sulfonic acid derivative (CHEBI:33552) |
| Manual Xrefs | Databases |
|---|---|
| LSM-3632 | LINCS |