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Biological and Environmental Research Ontology
Last uploaded:
December 23, 2022
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| Preferred Name | dofetilide | |
| Synonyms |
beta-((p-Methanesulfonamidophenethyl)methylamino)methanesulfono-p-phenetidide dofetilidum Tikosyn dofetilida dofetilide N-(4-{2-[methyl(2-{4-[(methylsulfonyl)amino]phenoxy}ethyl)amino]ethyl}phenyl)methanesulfonamide Dofetilide |
|
| Definitions |
A tertiary amino compound that is N-ethyl-N-methylethanamine substituted by a 4-[(methylsulfonyl)amino]phenoxy and a 4-[(methylsulfonyl)amino]phenyl group at the terminal carbon atoms respectively. It is used as an anti-arrhythmia drug. |
|
| ID |
http://purl.obolibrary.org/obo/CHEBI_4681 |
|
| alternative term |
beta-((p-Methanesulfonamidophenethyl)methylamino)methanesulfono-p-phenetidide dofetilidum Tikosyn dofetilida dofetilide N-(4-{2-[methyl(2-{4-[(methylsulfonyl)amino]phenoxy}ethyl)amino]ethyl}phenyl)methanesulfonamide Dofetilide
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|
| bearer of | ||
| charge |
0
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| database_cross_reference |
Reaxys:3572833 CAS:115256-11-6 LINCS:LSM-5925 KEGG:C07751 KEGG:D00647 PMID:11326815 DrugBank:DB00204 Wikipedia:Dofetilide PMID:25620152 Patent:EP245997 Patent:US4959366 Drug_Central:942 PMID:25626340
|
|
| definition |
A tertiary amino compound that is N-ethyl-N-methylethanamine substituted by a 4-[(methylsulfonyl)amino]phenoxy and a 4-[(methylsulfonyl)amino]phenyl group at the terminal carbon atoms respectively. It is used as an anti-arrhythmia drug.
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|
| formula |
C19H27N3O5S2
|
|
| has_exact_synonym |
N-(4-{2-[methyl(2-{4-[(methylsulfonyl)amino]phenoxy}ethyl)amino]ethyl}phenyl)methanesulfonamide Dofetilide
|
|
| has_obo_namespace |
chebi_ontology
|
|
| has_related_synonym |
beta-((p-Methanesulfonamidophenethyl)methylamino)methanesulfono-p-phenetidide dofetilidum Tikosyn dofetilida dofetilide
|
|
| id |
CHEBI:4681
|
|
| in_subset | ||
| inchi |
InChI=1S/C19H27N3O5S2/c1-22(13-12-16-4-6-17(7-5-16)20-28(2,23)24)14-15-27-19-10-8-18(9-11-19)21-29(3,25)26/h4-11,20-21H,12-15H2,1-3H3
|
|
| inchikey |
IXTMWRCNAAVVAI-UHFFFAOYSA-N
|
|
| label |
dofetilide
|
|
| mass |
441.56500
|
|
| monoisotopicmass |
441.13921
|
|
| notation |
CHEBI:4681
|
|
| prefLabel |
dofetilide
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|
| RO_0000087 | ||
| smiles |
CN(CCOc1ccc(NS(C)(=O)=O)cc1)CCc1ccc(NS(C)(=O)=O)cc1
|
|
| subClassOf |
http://purl.obolibrary.org/obo/CHEBI_35358 |
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