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CHEBI:94573 - zibotentan

ChEBI IDCHEBI:94573
ChEBI Namezibotentan
Stars
DefinitionA member of the class of pyridinesulfonamides that is benzene substituted by 3-[(3-methoxy-5-methylpyrazin-2-yl)sulfamoyl]pyridin-2-yl and 1,3,4-oxadiazol-2-yl groups at positions 1 and 4, respectively. It is an endothelin A receptor antagonist with potential antineoplastic activity.
Last Modified14 June 2024
DownloadsMolfile
FormulaC19H16N6O4S
Net Charge0
Average Mass424.442
Monoisotopic Mass424.09537
SMILESCOc1nc(C)cnc1NS(=O)(=O)c1cccnc1-c1ccc(-c2nnco2)cc1
InChIInChI=1S/C19H16N6O4S/c1-12-10-21-17(19(23-12)28-2)25-30(26,27)15-4-3-9-20-16(15)13-5-7-14(8-6-13)18-24-22-11-29-18/h3-11H,1-2H3,(H,21,25)
InChIKeyFJHHZXWJVIEFGJ-UHFFFAOYSA-N
Wikipedia
Roles Classification
Biological Role:
endothelin A receptor antagonist  A endothelin receptor antagonist is a drug which selectively blocks endothelin A receptors.
Applications:
endothelin A receptor antagonist  A endothelin receptor antagonist is a drug which selectively blocks endothelin A receptors.
antineoplastic agent  A substance that inhibits or prevents the proliferation of neoplasms.
antihypertensive agent  Any drug used in the treatment of acute or chronic vascular hypertension regardless of pharmacological mechanism.
ChEBI Ontology
Outgoing Relation(s)
zibotentan (CHEBI:94573) has role antihypertensive agent (CHEBI:35674)
zibotentan (CHEBI:94573) has role antineoplastic agent (CHEBI:35610)
zibotentan (CHEBI:94573) has role endothelin A receptor antagonist (CHEBI:51452)
zibotentan (CHEBI:94573) is a 1,3,4-oxadiazoles (CHEBI:46810)
zibotentan (CHEBI:94573) is a aromatic ether (CHEBI:35618)
zibotentan (CHEBI:94573) is a benzenes (CHEBI:22712)
zibotentan (CHEBI:94573) is a phenylpyridine (CHEBI:38193)
zibotentan (CHEBI:94573) is a pyrazines (CHEBI:38314)
zibotentan (CHEBI:94573) is a pyridinesulfonamide (CHEBI:48100)
IUPAC Name 
N-(3-methoxy-5-methylpyrazin-2-yl)-2-[4-(1,3,4-oxadiazol-2-yl)phenyl]pyridine-3-sulfonamide
Synonyms  Source
N-(3-methoxy-5-methyl-2-pyrazinyl)-2-[4-(1,3,4-oxadiazol-2-yl)phenyl]-3-pyridinesulfonamideChEBI
AZD-4054DrugBank
ZD4054DrugBank
ZD-4054DrugBank
ZD 4054ChEBI
Manual XrefsDatabases
LSM-5453LINCS
DB06629DrugBank
HMDB0260003HMDB
D07741KEGG DRUG
ZibotentanWikipedia
Registry NumbersSources
CAS:186497-07-4ChEBI
Citations