EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C24H21ClN8O2 |
| Net Charge | 0 |
| Average Mass | 488.939 |
| Monoisotopic Mass | 488.14760 |
| SMILES | N#Cc1cccc(NC(=O)N2CCC(c3nc4n(Cc5cccc(Cl)c5)nnc-4c(=O)n3)CC2)c1 |
| InChI | InChI=1S/C24H21ClN8O2/c25-18-5-1-4-16(11-18)14-33-22-20(30-31-33)23(34)29-21(28-22)17-7-9-32(10-8-17)24(35)27-19-6-2-3-15(12-19)13-26/h1-6,11-12,17,31H,7-10,14H2,(H,27,35) |
| InChIKey | QNXATBCWXJQUSE-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 4-[3-[(3-chlorophenyl)methyl]-7-oxo-2H-triazolo[4,5-d]pyrimidin-5-yl]-N-(3-cyanophenyl)-1-piperidinecarboxamide (CHEBI:112214) is a ureas (CHEBI:47857) |
| Manual Xrefs | Databases |
|---|---|
| LSM-23626 | LINCS |