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CHEBI:47727 - 5-{5-[2-chloro-4-(4,5-dihydro-1,3-oxazol-2-yl)phenoxy]pentyl}-3-methylisoxazole

ChEBI IDCHEBI:47727
ChEBI Name5-{5-[2-chloro-4-(4,5-dihydro-1,3-oxazol-2-yl)phenoxy]pentyl}-3-methylisoxazole
Stars
DefinitionAn isoxazole compound having a methyl substituent at the 3-position and a 5-[2-chloro-4-(4,5-dihydro-1,3-oxazol-2-yl)phenoxy]pentyl substituent at the 5-position.
Last Modified17 June 2021
DownloadsMolfile
FormulaC18H21ClN2O3
Net Charge0
Average Mass348.830
Monoisotopic Mass348.12407
SMILESCc1cc(CCCCCOc2ccc(C3=NCCO3)cc2Cl)on1
InChIInChI=1S/C18H21ClN2O3/c1-13-11-15(24-21-13)5-3-2-4-9-22-17-7-6-14(12-16(17)19)18-20-8-10-23-18/h6-7,11-12H,2-5,8-10H2,1H3
InChIKeyFCSKOFQQCWLGMV-UHFFFAOYSA-N
Roles Classification
Biological Role:
antiviral agent  A substance that destroys or inhibits replication of viruses.
ChEBI Ontology
Outgoing Relation(s)
5-{5-[2-chloro-4-(4,5-dihydro-1,3-oxazol-2-yl)phenoxy]pentyl}-3-methylisoxazole (CHEBI:47727) has role antiviral agent (CHEBI:22587)
5-{5-[2-chloro-4-(4,5-dihydro-1,3-oxazol-2-yl)phenoxy]pentyl}-3-methylisoxazole (CHEBI:47727) is a isoxazoles (CHEBI:55373)
5-{5-[2-chloro-4-(4,5-dihydro-1,3-oxazol-2-yl)phenoxy]pentyl}-3-methylisoxazole (CHEBI:47727) is a monochlorobenzenes (CHEBI:83403)
Synonyms  Source
Win-53338ChemIDplus
Win 53338ChemIDplus
5-(5-(6-Chloro-4-(4,5-dihydro-2-oxazolyl)phenoxy)pentyl)-3-methylisoxazoleKEGG COMPOUND
Manual XrefsDatabases
W33PDBeChem
C06489KEGG COMPOUND
Registry NumbersSources
Beilstein:3627109Beilstein
CAS:98033-68-2ChemIDplus
Citations