CHEBI:31269 - Benzylhydrochlorothiazide

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ChEBI Name Benzylhydrochlorothiazide
ChEBI ID CHEBI:31269
Stars This entity has been manually annotated by a third party.
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Formulae C14H14ClN3O4S2
C14H14ClN3O4S2
Net Charge 0
Average Mass 387.864
Monoisotopic Mass 387.01143
InChI InChI=1S/C14H14ClN3O4S2/c15-10-7-11-13(8-12(10)23(16,19)20)24(21,22)18-14(17-11)6-9-4-2-1-3-5-9/h1-5,7-8,14,17-18H,6H2,(H2,16,19,20)
InChIKey BWSSMIJUDVUASQ-UHFFFAOYSA-N
SMILES C12=C(C=C(S(N)(=O)=O)C(=C1)Cl)S(NC(N2)CC=3C=CC=CC3)(=O)=O
Roles Classification
Chemical Role(s): Bronsted base
A molecular entity capable of accepting a hydron from a donor (Bronsted acid).
(via organic amino compound )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing Benzylhydrochlorothiazide (CHEBI:31269) is a benzenes (CHEBI:22712)
Benzylhydrochlorothiazide (CHEBI:31269) is a benzothiadiazine (CHEBI:50265)
Benzylhydrochlorothiazide (CHEBI:31269) is a organochlorine compound (CHEBI:36683)
Benzylhydrochlorothiazide (CHEBI:31269) is a secondary amino compound (CHEBI:50995)
Benzylhydrochlorothiazide (CHEBI:31269) is a sulfonamide (CHEBI:35358)
Synonyms Sources
behyd DrugCentral
benclortriazide DrugCentral
benzclortriazide DrugCentral
Benzylhydrochlorothiazide KEGG COMPOUND
Manual Xrefs Databases
336 DrugCentral
C12675 KEGG COMPOUND
D01246 KEGG DRUG
View more database links
Registry Number Type Source
1824-50-6 CAS Registry Number KEGG COMPOUND
Last Modified
13 March 2018