EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C24H30N4O4S |
| Net Charge | 0 |
| Average Mass | 470.595 |
| Monoisotopic Mass | 470.19878 |
| SMILES | CCOC(=O)N1CCN(C(=O)c2ccc3c(=O)n(CCC4=CCCCC4)c(=S)nc3c2)CC1 |
| InChI | InChI=1S/C24H30N4O4S/c1-2-32-24(31)27-14-12-26(13-15-27)21(29)18-8-9-19-20(16-18)25-23(33)28(22(19)30)11-10-17-6-4-3-5-7-17/h6,8-9,16H,2-5,7,10-15H2,1H3,(H,25,33) |
| InChIKey | YJNYMVSEUUODFE-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 4-[[3-[2-(1-cyclohexenyl)ethyl]-4-oxo-2-sulfanylidene-1H-quinazolin-7-yl]-oxomethyl]-1-piperazinecarboxylic acid ethyl ester (CHEBI:121998) is a quinazolines (CHEBI:38530) |
| Manual Xrefs | Databases |
|---|---|
| LSM-33441 | LINCS |