EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C16H9N3O3S |
| Net Charge | 0 |
| Average Mass | 323.333 |
| Monoisotopic Mass | 323.03646 |
| SMILES | O=C(Nc1ccc2c(c1)C(=O)NC2=O)c1ccc2ncsc2c1 |
| InChI | InChI=1S/C16H9N3O3S/c20-14(8-1-4-12-13(5-8)23-7-17-12)18-9-2-3-10-11(6-9)16(22)19-15(10)21/h1-7H,(H,18,20)(H,19,21,22) |
| InChIKey | IXOYMIUQSYKGNJ-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| N-(1,3-dioxo-5-isoindolyl)-1,3-benzothiazole-6-carboxamide (CHEBI:109369) is a phthalimides (CHEBI:82851) |
| Manual Xrefs | Databases |
|---|---|
| LSM-20767 | LINCS |