EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C16H14N2O4S3 |
| Net Charge | 0 |
| Average Mass | 394.499 |
| Monoisotopic Mass | 394.01157 |
| SMILES | CS(=O)(=O)c1ccc2nc(NC(=O)CCC(=O)c3cccs3)sc2c1 |
| InChI | InChI=1S/C16H14N2O4S3/c1-25(21,22)10-4-5-11-14(9-10)24-16(17-11)18-15(20)7-6-12(19)13-3-2-8-23-13/h2-5,8-9H,6-7H2,1H3,(H,17,18,20) |
| InChIKey | SSAYLFVGTIMJLI-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-4-oxo-4-thiophen-2-ylbutanamide (CHEBI:115033) is a benzothiazoles (CHEBI:37947) |
| Manual Xrefs | Databases |
|---|---|
| LSM-26495 | LINCS |