EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C13H14N4O3S |
| Net Charge | 0 |
| Average Mass | 306.347 |
| Monoisotopic Mass | 306.07866 |
| SMILES | COC1=CC(=CNNC(=O)c2sc(N)nc2C)C=CC1=O |
| InChI | InChI=1S/C13H14N4O3S/c1-7-11(21-13(14)16-7)12(19)17-15-6-8-3-4-9(18)10(5-8)20-2/h3-6,15H,1-2H3,(H2,14,16)(H,17,19) |
| InChIKey | GWZNPASNPCZNMZ-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 2-amino-N'-[(3-methoxy-4-oxo-1-cyclohexa-2,5-dienylidene)methyl]-4-methyl-5-thiazolecarbohydrazide (CHEBI:94544) is a aromatic amide (CHEBI:62733) |
| 2-amino-N'-[(3-methoxy-4-oxo-1-cyclohexa-2,5-dienylidene)methyl]-4-methyl-5-thiazolecarbohydrazide (CHEBI:94544) is a thiazoles (CHEBI:48901) |
| Manual Xrefs | Databases |
|---|---|
| LSM-5379 | LINCS |