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CHEBI:3654 - chlorthalidone

Default Structure
ChEBI IDCHEBI:3654
ChEBI Namechlorthalidone
Stars
Last Modified22 February 2017
DownloadsMolfile
FormulaC14H11ClN2O4S
Net Charge0
Average Mass338.772
Monoisotopic Mass338.01281
SMILESNS(=O)(=O)c1cc(C2(O)NC(=O)c3ccccc32)ccc1Cl
InChIInChI=1S/C14H11ClN2O4S/c15-11-6-5-8(7-12(11)22(16,20)21)14(19)10-4-2-1-3-9(10)13(18)17-14/h1-7,19H,(H,17,18)(H2,16,20,21)
InChIKeyJIVPVXMEBJLZRO-UHFFFAOYSA-N
Wikipedia
ChEBI Ontology
Outgoing Relation(s)
chlorthalidone (CHEBI:3654) is a isoindoles (CHEBI:24897)
chlorthalidone (CHEBI:3654) is a monochlorobenzenes (CHEBI:83403)
chlorthalidone (CHEBI:3654) is a sulfonamide (CHEBI:35358)
IUPAC Name 
2-chloro-5-(1-hydroxy-3-oxo-2,3-dihydro-1H-isoindol-1-yl)benzenesulfonamide
Synonyms  Source
1-keto-3-(3'-sulfamyl-4'-chlorophenyl)-3-hydroxyisoindolineChemIDplus
1-oxo-3-(3-sulfamyl-4-chlorophenyl)-3-hydroxyisoindolineChemIDplus
2-chloro-5-(1-hydroxy-3-oxo-1-isoindolinyl)benzenesulfonamideChemIDplus
2-chloro-5-(2,3-dihydro-1-hydroxy-3-oxo-1H-isoindol-1-yl)benzenesulfonamideChemIDplus
3-(4'-chloro-3'-sulfamoylphenyl)-3-hydroxyphthalimidineChemIDplus
3-hydroxy-3-(4-chloro-3-sulfamylphenyl)phthalimidineChemIDplus
Manual XrefsDatabases
625DrugCentral
ChlorthalidoneWikipedia
D00272KEGG DRUG
DB00310DrugBank
LSM-1417LINCS
Registry NumbersSources
Beilstein:312295Beilstein
CAS:77-36-1ChemIDplus
CAS:77-36-1KEGG COMPOUND