EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C23H14N2O3S |
| Net Charge | 0 |
| Average Mass | 398.443 |
| Monoisotopic Mass | 398.07251 |
| SMILES | O=C(Nc1cccc(-c2nc3ccccc3s2)c1)c1cc(=O)c2ccccc2o1 |
| InChI | InChI=1S/C23H14N2O3S/c26-18-13-20(28-19-10-3-1-8-16(18)19)22(27)24-15-7-5-6-14(12-15)23-25-17-9-2-4-11-21(17)29-23/h1-13H,(H,24,27) |
| InChIKey | BUJIYFGLGJNWSA-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| N-[3-(1,3-benzothiazol-2-yl)phenyl]-4-oxo-1-benzopyran-2-carboxamide (CHEBI:105742) is a aromatic amide (CHEBI:62733) |
| Manual Xrefs | Databases |
|---|---|
| LSM-17104 | LINCS |