chlorothiazide (CHEBI:3640)

ChEBI > Main

Main

ChEBI Ontology

Automatic Xrefs

Reactions

Pathways

Models

ChEBI Name	chlorothiazide

ChEBI ID	CHEBI:3640

Definition	4H-1,2,4-benzothiadiazine 1,1-dioxide in which the hydrogen at position is substituted by chlorine and that at position 7 is substituted by a sulfonamide group. A diuretic, it is used for treatment of oedema and hypertension.

Stars	This entity has been manually annotated by the ChEBI Team.

Secondary ChEBI IDs	CHEBI:162615

Supplier Information

Download	Molfile XML SDF

Wikipedia	License

Read full article at Wikipedia

Formula

C7H6ClN3O4S2

Net Charge

Average Mass

295.72300

Monoisotopic Mass

294.94883

InChI

InChI=1S/C7H6ClN3O4S2/c8-4-1-5-7(2-6(4)16(9,12)13)17(14,15)11-3-10-5/h1-3H,(H,10,11)(H2,9,12,13)

InChIKey

JBMKAUGHUNFTOL-UHFFFAOYSA-N

SMILES

NS(=O)(=O)c1cc2c(NC=NS2(=O)=O)cc1Cl

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.

ChEBI Ontology
Outgoing	chlorothiazide (CHEBI:3640) has role antihypertensive agent (CHEBI:35674) chlorothiazide (CHEBI:3640) has role diuretic (CHEBI:35498) chlorothiazide (CHEBI:3640) is a benzothiadiazine (CHEBI:50265)

IUPAC Name

6-chloro-4H-1,2,4-benzothiadiazine-7-sulfonamide 1,1-dioxide

Synonyms	Sources
6-Chloro-1,1-dioxo-1,2-dihydro-1lambda6-benzo[1,2,4]thiadiazine-7-sulfonic acid amide	ChEMBL
6-chloro-7-sulfamoyl-2H-1,2,4-benzothiadiazine 1,1-dioxide	ChemIDplus
Chlorothiazide	KEGG COMPOUND

Last Modified

25 May 2018