EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C22H23ClN4O4 |
| Net Charge | 0 |
| Average Mass | 442.903 |
| Monoisotopic Mass | 442.14078 |
| SMILES | CCOC(=O)CCNC(=O)Nc1ccc2nc(C)n(Cc3ccc(Cl)cc3)c(=O)c2c1 |
| InChI | InChI=1S/C22H23ClN4O4/c1-3-31-20(28)10-11-24-22(30)26-17-8-9-19-18(12-17)21(29)27(14(2)25-19)13-15-4-6-16(23)7-5-15/h4-9,12H,3,10-11,13H2,1-2H3,(H2,24,26,30) |
| InChIKey | RFBPBRWPSOSLOB-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 3-[[[[3-[(4-chlorophenyl)methyl]-2-methyl-4-oxo-6-quinazolinyl]amino]-oxomethyl]amino]propanoic acid ethyl ester (CHEBI:116324) is a quinazolines (CHEBI:38530) |
| Manual Xrefs | Databases |
|---|---|
| LSM-27778 | LINCS |