EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C19H17ClFN5S.C4H4O4 |
| Net Charge | 0 |
| Average Mass | 517.970 |
| Monoisotopic Mass | 517.09868 |
| SMILES | N#Cc1cc(CN2CCC(Nc3ncnc4sc(Cl)cc34)CC2)ccc1F.O=C(O)/C=C/C(=O)O |
| InChI | InChI=1S/C19H17ClFN5S.C4H4O4/c20-17-8-15-18(23-11-24-19(15)27-17)25-14-3-5-26(6-4-14)10-12-1-2-16(21)13(7-12)9-22;5-3(6)1-2-4(7)8/h1-2,7-8,11,14H,3-6,10H2,(H,23,24,25);1-2H,(H,5,6)(H,7,8)/b;2-1+ |
| InChIKey | RPYIKXHIQXRXEM-WLHGVMLRSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| prx-08066 (CHEBI:756819) is a piperidines (CHEBI:26151) |
| Synonym | Source |
|---|---|
| Prx-08066 | ChEMBL |