EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C23H20N4O4S |
| Net Charge | 0 |
| Average Mass | 448.504 |
| Monoisotopic Mass | 448.12053 |
| SMILES | COc1ccc(C=C2N=C(SCC(=O)Nc3cc(C)on3)N(c3ccccc3)C2=O)cc1 |
| InChI | InChI=1S/C23H20N4O4S/c1-15-12-20(26-31-15)25-21(28)14-32-23-24-19(13-16-8-10-18(30-2)11-9-16)22(29)27(23)17-6-4-3-5-7-17/h3-13H,14H2,1-2H3,(H,25,26,28) |
| InChIKey | LYBGHJWHZSMJAA-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 2-[[4-[(4-methoxyphenyl)methylidene]-5-oxo-1-phenyl-2-imidazolyl]thio]-N-(5-methyl-3-isoxazolyl)acetamide (CHEBI:109096) has functional parent α-amino acid (CHEBI:33704) |
| 2-[[4-[(4-methoxyphenyl)methylidene]-5-oxo-1-phenyl-2-imidazolyl]thio]-N-(5-methyl-3-isoxazolyl)acetamide (CHEBI:109096) is a organonitrogen compound (CHEBI:35352) |
| 2-[[4-[(4-methoxyphenyl)methylidene]-5-oxo-1-phenyl-2-imidazolyl]thio]-N-(5-methyl-3-isoxazolyl)acetamide (CHEBI:109096) is a organooxygen compound (CHEBI:36963) |
| Manual Xrefs | Databases |
|---|---|
| LSM-20494 | LINCS |