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Details

Stereochemistry ACHIRAL
Molecular Formula C19H27N3O5S2
Molecular Weight 447.589
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Dofetilide H-3

SMILES

[3H]C([3H])([3H])N(CCOC1=CC=C(NS(C)(=O)=O)C=C1)CCC2=CC=C(NS(C)(=O)=O)C=C2

InChI

InChIKey=IXTMWRCNAAVVAI-RLXJOQACSA-N
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/i1T3

HIDE SMILES / InChI

Molecular Formula C19H27N3O5S2
Molecular Weight 447.589
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 20:10:58 UTC 2023
Edited
by admin
on Sat Dec 16 20:10:58 UTC 2023
Record UNII
K46LKD24P7
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Dofetilide H-3
Common Name English
N-[4-[2-[Methyl-t3-[2-[4-[(methylsulfonyl)amino]phenoxy]ethyl]amino]ethyl]phenyl]methanesulfonamide
Systematic Name English
[3H]Dofetilide
Common Name English
Methanesulfonamide, N-[4-[2-[methyl-t3-[2-[4-[(methylsulfonyl)amino]phenoxy]ethyl]amino]ethyl]phenyl]-
Systematic Name English
Code System Code Type Description
FDA UNII
K46LKD24P7
Created by admin on Sat Dec 16 20:10:58 UTC 2023 , Edited by admin on Sat Dec 16 20:10:58 UTC 2023
PRIMARY
CAS
2086336-96-9
Created by admin on Sat Dec 16 20:10:58 UTC 2023 , Edited by admin on Sat Dec 16 20:10:58 UTC 2023
PRIMARY
Related Record Type Details
NON-LABELED -> LABELED
TARGET->RADIOLIGAND
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