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CHEBI:64354 - metolazone

ChEBI IDCHEBI:64354
ChEBI Namemetolazone
Stars
DefinitionA quinazoline that consists of 1,2,3,4-tetrahydroquinazolin-4-one bearing additional methyl, 2-tolyl, sulfamyl and chloro substituents at positions 2, 3, 6 and 7 respectively. A quinazoline diuretic, with properties similar to thiazide diuretics.
Secondary ChEBI IDCHEBI:6903
Last Modified22 February 2017
DownloadsMolfile
FormulaC16H16ClN3O3S
Net Charge0
Average Mass365.842
Monoisotopic Mass365.06009
SMILESCc1ccccc1N1C(=O)c2cc(S(N)(=O)=O)c(Cl)cc2NC1C
InChIInChI=1S/C16H16ClN3O3S/c1-9-5-3-4-6-14(9)20-10(2)19-13-8-12(17)15(24(18,22)23)7-11(13)16(20)21/h3-8,10,19H,1-2H3,(H2,18,22,23)
InChIKeyAQCHWTWZEMGIFD-UHFFFAOYSA-N
Wikipedia
Roles Classification
Biological Role:
ion transport inhibitor  A compound which inhibits the movement of an ion across an energy-transducing cell membrane.
Applications:
antihypertensive agent  Any drug used in the treatment of acute or chronic vascular hypertension regardless of pharmacological mechanism.
diuretic  An agent that promotes the excretion of urine through its effects on kidney function.
ChEBI Ontology
Outgoing Relation(s)
metolazone (CHEBI:64354) has role antihypertensive agent (CHEBI:35674)
metolazone (CHEBI:64354) has role diuretic (CHEBI:35498)
metolazone (CHEBI:64354) has role ion transport inhibitor (CHEBI:50184)
metolazone (CHEBI:64354) is a organochlorine compound (CHEBI:36683)
metolazone (CHEBI:64354) is a quinazolines (CHEBI:38530)
metolazone (CHEBI:64354) is a sulfonamide (CHEBI:35358)
IUPAC Name 
7-chloro-2-methyl-3-(2-methylphenyl)-4-oxo-1,2,3,4-tetrahydroquinazoline-6-sulfonamide
INNs  Source
metolazoneKEGG DRUG
metolazonaDrugBank
metolazonumDrugBank
Synonyms  Source
2-Methyl-3-o-tolyl-6-sulfamyl-7-chloro-1,2,3,4-tetrahydro-4-quinazolinoneChemIDplus
7-Chloro-1,2,3,4-tetrahydro-2-methyl-3-(2-methylphenyl)-4-oxo-6-quinazolinesulfonamideChemIDplus
7-Chloro-1,2,3,4-tetrahydro-2-methyl-4-oxo-3-o-tolyl-6-quinazolinesulfonamideChemIDplus
Brand Name  Source
ZaroxolynDrugBank
Manual XrefsDatabases
D00431KEGG DRUG
DB00524DrugBank
US2008139593Patent
MetolazoneWikipedia
US3360518Patent
LSM-1680LINCS
1783DrugCentral
Registry NumbersSources
Reaxys:965506Reaxys
CAS:17560-51-9ChemIDplus
CAS:17560-51-9NIST Chemistry WebBook
Citations