EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C23H21N5O2S |
| Net Charge | 0 |
| Average Mass | 431.521 |
| Monoisotopic Mass | 431.14160 |
| SMILES | Cc1ccc(-n2ncc3c(=O)nc(SCC(=O)N4CCCc5ccccc54)nc2-3)cc1 |
| InChI | InChI=1S/C23H21N5O2S/c1-15-8-10-17(11-9-15)28-21-18(13-24-28)22(30)26-23(25-21)31-14-20(29)27-12-4-6-16-5-2-3-7-19(16)27/h2-3,5,7-11,13,24H,4,6,12,14H2,1H3 |
| InChIKey | FZYQKKSSGUJQNQ-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 6-[[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]thio]-1-(4-methylphenyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one (CHEBI:120884) is a pyrazoles (CHEBI:26410) |
| 6-[[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]thio]-1-(4-methylphenyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one (CHEBI:120884) is a ring assembly (CHEBI:36820) |
| Manual Xrefs | Databases |
|---|---|
| LSM-32327 | LINCS |