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CHEBI:232342 - SLC-0111

ChEBI IDCHEBI:232342
ChEBI NameSLC-0111
Stars
DefinitionIt is a potent carbonic anhydrase inhibitor (Ki = 45.1 nM and 4.5 nM for CA IX and CA XII, respectively) that is in clinical trials for the treatment of hypoxic malignancies .
Last Modified23 October 2024
SubmitterFlyBase
DownloadsMolfile
FormulaC13H12FN3O3S
Net Charge0
Average Mass309.322
Monoisotopic Mass309.05834
SMILESNS(=O)(=O)c1ccc(NC(=O)Nc2ccc(F)cc2)cc1
InChIInChI=1S/C13H12FN3O3S/c14-9-1-3-10(4-2-9)16-13(18)17-11-5-7-12(8-6-11)21(15,19)20/h1-8H,(H2,15,19,20)(H2,16,17,18)
InChIKeyYJQZNWPYLCNRLP-UHFFFAOYSA-N
Roles Classification
Biological Role:
EC 4.2.1.1 (carbonic anhydrase) inhibitor  An EC 4.2.1.* (hydro-lyases) inhibitor that interferes with the action of carbonic anhydrase (EC 4.2.1.1). Such compounds reduce the secretion of H+ ions by the proximal kidney tubule.
Application:
antineoplastic agent  A substance that inhibits or prevents the proliferation of neoplasms.
ChEBI Ontology
Outgoing Relation(s)
SLC-0111 (CHEBI:232342) has role antineoplastic agent (CHEBI:35610)
SLC-0111 (CHEBI:232342) has role EC 4.2.1.1 (carbonic anhydrase) inhibitor (CHEBI:23018)
SLC-0111 (CHEBI:232342) is a monofluorobenzenes (CHEBI:83575)
SLC-0111 (CHEBI:232342) is a phenylureas (CHEBI:134043)
SLC-0111 (CHEBI:232342) is a sulfonamide (CHEBI:35358)
IUPAC Name 
4-{[(4-fluorophenyl)carbamoyl]amino}benzenesulfonamide
Synonyms  Source
4-{[(4-fluorophenyl)carbamoyl]amino}benzene-1-sulfonamideIUPAC
U-104DrugBank
U104DrugBank
SLC0111DrugBank
SLC 0111ChEBI
U 104ChEBI
Manual XrefsDatabases
DB18815DrugBank
WWZPDBeChem
Registry NumbersSources
CAS:178606-66-1DrugBank
Citations