EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C19H15N3O4S |
| Net Charge | 0 |
| Average Mass | 381.413 |
| Monoisotopic Mass | 381.07833 |
| SMILES | O=C(COc1cccnc1[N+](=O)[O-])Nc1ccccc1Sc1ccccc1 |
| InChI | InChI=1S/C19H15N3O4S/c23-18(13-26-16-10-6-12-20-19(16)22(24)25)21-15-9-4-5-11-17(15)27-14-7-2-1-3-8-14/h1-12H,13H2,(H,21,23) |
| InChIKey | BXRLXYZTIQWMED-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 2-[(2-nitro-3-pyridinyl)oxy]-N-[2-(phenylthio)phenyl]acetamide (CHEBI:121255) is a aryl sulfide (CHEBI:35683) |
| Manual Xrefs | Databases |
|---|---|
| LSM-32698 | LINCS |