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bendroflumethiazide (CHEBI:3013)

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ChEBI Name bendroflumethiazide
ChEBI ID CHEBI:3013
Definition A sulfonamide consisting of 7-sulfamoyl-3,4-dihydro-2H-1,2,4-benzothiadiazine 1,1-dioxide in which the hydrogen at position 6 is substituted by a trifluoromethyl group and that at position 3 is substituted by a benzyl group.
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:615239
Supplier Information
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Formula Source
C15H14F3N3O4S2 KEGG COMPOUND
Net Charge 0
Average Mass 421.41500
InChI
InChI=1S/C15H14F3N3O4S2/c16-15(17,18)10-7-11-13(8-12(10)26(19,22)23)27(24,25)21-14(20-11)6-9-4-2-1-3-5-9/h1-5,7-8,14,20-21H,6H2,(H2,19,22,23)
InChIKey
HDWIHXWEUNVBIY-UHFFFAOYSA-N
SMILES
NS(=O)(=O)c1cc2c(NC(Cc3ccccc3)NS2(=O)=O)cc1C(F)(F)F
Roles Classification
Application(s): diuretic
An agent that promotes the excretion of urine through its effects on kidney function.
antihypertensive agent
Any drug used in the treatment of acute or chronic vascular hypertension regardless of pharmacological mechanism.
View more on the ChEBI Ontology
ChEBI Ontology
Outgoing bendroflumethiazide (CHEBI:3013) has role antihypertensive agent (CHEBI:35674)
bendroflumethiazide (CHEBI:3013) has role diuretic (CHEBI:35498)
bendroflumethiazide (CHEBI:3013) is a benzothiadiazine (CHEBI:50265)
bendroflumethiazide (CHEBI:3013) is a sulfonamide (CHEBI:35358)
Incoming (R)-bendroflumethiazide (CHEBI:59243) is a bendroflumethiazide (CHEBI:3013)
(S)-bendroflumethiazide (CHEBI:59244) is a bendroflumethiazide (CHEBI:3013)
IUPAC Name
3-benzyl-6-(trifluoromethyl)-3,4-dihydro-2H-1,2,4-benzothiadiazine-7-sulfonamide 1,1-dioxide
INNs Sources
bendroflumethiazide KEGG DRUG
bendroflumethiazidum ChemIDplus
bendroflumetiazida ChemIDplus
Synonyms Sources
±-3-benzyl-3,4-dihydro-6-(trifluoromethyl)-2H-1,2,4-benzothiadiazine-7-sulfonamide 1,1-dioxide ChemIDplus
6-trifluoromethyl-3-benzyl-7-sulfamyl-3,4-dihydro-1,2,4-benzothiadiazine 1,1-dioxide ChemIDplus
bendrofluazide ChemIDplus
Bendroflumethiazide KEGG COMPOUND
benzhydroflumethiazide ChemIDplus
Database Links Databases
Bendroflumethiazide Wikipedia
C07758 KEGG COMPOUND
D00650 KEGG DRUG
DB00436 DrugBank
GB863474 Patent
US3392168 Patent
View more database links
Registry Numbers Types Sources
373316 Reaxys Registry Number Reaxys
373316 Beilstein Registry Number Beilstein
73-48-3 CAS Registry Number KEGG COMPOUND
73-48-3 CAS Registry Number ChemIDplus
Citation Waiting for Citations Type Source
19056282 PubMed citation ChEMBL
General Comment
2011-06-27 A thiazide diuretic, it is used in the treatment of familial hyperkalemia, hypertension, edema, and urinary tract disorders.
 
Last Modified
28 juin 2011

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