EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C13H16N4O4S |
| Net Charge | 0 |
| Average Mass | 324.362 |
| Monoisotopic Mass | 324.08923 |
| SMILES | CCCCC(=O)NNC(=S)NC(=O)c1cccc([N+](=O)[O-])c1 |
| InChI | InChI=1S/C13H16N4O4S/c1-2-3-7-11(18)15-16-13(22)14-12(19)9-5-4-6-10(8-9)17(20)21/h4-6,8H,2-3,7H2,1H3,(H,15,18)(H2,14,16,19,22) |
| InChIKey | FAJDETCVQBTNNR-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 3-nitro-N-[(1-oxopentylhydrazo)-sulfanylidenemethyl]benzamide (CHEBI:112740) is a C-nitro compound (CHEBI:35716) |
| Manual Xrefs | Databases |
|---|---|
| LSM-24150 | LINCS |