CHEBI:102516 - sulfamethoxypyridazine

ChEBI IDCHEBI:102516
ChEBI Namesulfamethoxypyridazine
Stars
DefinitionA sulfonamide consisting of pyridazine having a methoxy substituent at the 6-position and a 4-aminobenzenesulfonamido group at the 3-position.
Last Modified4 March 2019
DownloadsMolfile
FormulaC11H12N4O3S
Net Charge0
Average Mass280.309
Monoisotopic Mass280.06301
SMILESCOc1ccc(NS(=O)(=O)c2ccc(N)cc2)nn1
InChIInChI=1S/C11H12N4O3S/c1-18-11-7-6-10(13-14-11)15-19(16,17)9-4-2-8(12)3-5-9/h2-7H,12H2,1H3,(H,13,15)
InChIKeyVLYWMPOKSSWJAL-UHFFFAOYSA-N
Roles Classification
Biological Roles:
drug allergen  Any drug which causes the onset of an allergic reaction.
EC 2.5.1.15 (dihydropteroate synthase) inhibitor  An EC 2.5.1.* (non-methyl-alkyl or aryl transferase) inhibitor that interferes with the action of dihydropteroate synthase (EC 2.5.1.15), an enzyme that catalyzes the formation of dihydropteroate from p-aminobenzoic acid and dihydropteridine-hydroxymethyl-pyrophosphate.
antimicrobial agent  A substance that kills or slows the growth of microorganisms, including bacteria, viruses, fungi and protozoans.
Applications:
drug allergen  Any drug which causes the onset of an allergic reaction.
antiinfective agent  A substance used in the prophylaxis or therapy of infectious diseases.
ChEBI Ontology
Outgoing Relation(s)
sulfamethoxypyridazine (CHEBI:102516) has functional parent sulfanilamide (CHEBI:45373)
sulfamethoxypyridazine (CHEBI:102516) has role antiinfective agent (CHEBI:35441)
sulfamethoxypyridazine (CHEBI:102516) has role drug allergen (CHEBI:88188)
sulfamethoxypyridazine (CHEBI:102516) has role EC 2.5.1.15 (dihydropteroate synthase) inhibitor (CHEBI:50502)
sulfamethoxypyridazine (CHEBI:102516) is a pyridazines (CHEBI:37921)
sulfamethoxypyridazine (CHEBI:102516) is a sulfonamide (CHEBI:35358)
sulfamethoxypyridazine (CHEBI:102516) is a sulfonamide antibiotic (CHEBI:87228)
IUPAC Name 
4-amino-N-(6-methoxypyridazin-3-yl)benzenesulfonamide
INNs  Source
sulfamethoxypyridazineKEGG DRUG
sulfamethoxypyridazinumChemIDplus
sulfametoxipiridazinaChemIDplus
Synonyms  Source
3-(4-Aminobenzenesulfonamido)-6-methoxypyridazineNIST Chemistry WebBook
3-Methoxy-6-sulfanylamidopyridazineChemIDplus
3-(p-Aminobenzenesulfamido)-6-methoxypyridazineChemIDplus
3-p-Aminobenzenesulphonamido-6-methoxypyridazineChemIDplus
3-Sulfa-6-methoxypyridazineChemIDplus
3-Sulfanilamide-6-methoxypyridazineChemIDplus
Manual XrefsDatabases
2515DrugCentral
D02439KEGG DRUG
LSM-5204LINCS
US2712012Patent
Registry NumbersSources
Gmelin:1443440Gmelin
Reaxys:277076Reaxys
CAS:80-35-3KEGG DRUG
CAS:80-35-3ChemIDplus
CAS:80-35-3NIST Chemistry WebBook
Citations