CHEBI:3640 - chlorothiazide

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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
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Formula C7H6ClN3O4S2
Net Charge 0
Average Mass 295.72300
Monoisotopic Mass 294.949
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.
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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
INNs Sources
chlorothiazide ChemIDplus
chlorothiazidum ChemIDplus
clorotiazida ChemIDplus
Synonyms Sources
6-Chloro-1,1-dioxo-1,2-dihydro-1lambda*6*-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
Manual Xrefs Databases
609 DrugCentral
C07461 KEGG COMPOUND
Chlorothiazide Wikipedia
D00519 KEGG DRUG
DB00880 DrugBank
LSM-5942 LINCS
US2809194 Patent
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Registry Numbers Types Sources
1084805 Beilstein Registry Number Beilstein
58-94-6 CAS Registry Number NIST Chemistry WebBook
58-94-6 CAS Registry Number ChemIDplus
Citations Waiting for Citations Types Sources
10891117 PubMed citation ChEMBL
2160536 PubMed citation ChEMBL
28166217 PubMed citation Europe PMC
29438107 PubMed citation Europe PMC
3712385 PubMed citation ChEMBL
Last Modified
25 May 2018