EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C23H28N4OS |
| Net Charge | 0 |
| Average Mass | 408.571 |
| Monoisotopic Mass | 408.19838 |
| SMILES | CN1Cc2c(N3CCOCC3)nc(SCc3ccccc3)c(C#N)c2CC1(C)C |
| InChI | InChI=1S/C23H28N4OS/c1-23(2)13-18-19(14-24)22(29-16-17-7-5-4-6-8-17)25-21(20(18)15-26(23)3)27-9-11-28-12-10-27/h4-8H,9-13,15-16H2,1-3H3 |
| InChIKey | ZKZWUEUAOWRWKC-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 6,6,7-trimethyl-1-(4-morpholinyl)-3-(phenylmethylthio)-5,8-dihydro-2,7-naphthyridine-4-carbonitrile (CHEBI:108038) is a naphthyridine derivative (CHEBI:73539) |
| Manual Xrefs | Databases |
|---|---|
| LSM-19415 | LINCS |