U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C32H46N2O7S2
Molecular Weight 634.847
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of N-Mesyldronedarone

SMILES

CCCCN(CCCC)CCCOC1=CC=C(C=C1)C(=O)C2=C(CCCC)OC3=CC=C(C=C23)N(S(C)(=O)=O)S(C)(=O)=O

InChI

InChIKey=IKGSSECULYFYER-UHFFFAOYSA-N
InChI=1S/C32H46N2O7S2/c1-6-9-13-30-31(28-24-26(16-19-29(28)41-30)34(42(4,36)37)43(5,38)39)32(35)25-14-17-27(18-15-25)40-23-12-22-33(20-10-7-2)21-11-8-3/h14-19,24H,6-13,20-23H2,1-5H3

HIDE SMILES / InChI

Molecular Formula C32H46N2O7S2
Molecular Weight 634.847
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 19:50:57 GMT 2023
Edited
by admin
on Sat Dec 16 19:50:57 GMT 2023
Record UNII
4XUK37HG5R
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
N-Mesyldronedarone
Common Name English
Dronedarone Hydrochloride Impurity C [Ep Impurity]
Common Name English
Methanesulfonamide, N-[2-butyl-3-[4-[3-(dibutylamino)propoxy]benzoyl]-5-benzofuranyl]-N-(methylsulfonyl)-
Systematic Name English
N-[2-Butyl-3-[4-[3-(dibutylamino)propoxy]benzoyl]-5-benzofuranyl]-N-(methylsulfonyl)methanesulfonamide
Systematic Name English
Code System Code Type Description
CAS
141626-57-5
Created by admin on Sat Dec 16 19:50:57 GMT 2023 , Edited by admin on Sat Dec 16 19:50:57 GMT 2023
PRIMARY
FDA UNII
4XUK37HG5R
Created by admin on Sat Dec 16 19:50:57 GMT 2023 , Edited by admin on Sat Dec 16 19:50:57 GMT 2023
PRIMARY
PUBCHEM
56941271
Created by admin on Sat Dec 16 19:50:57 GMT 2023 , Edited by admin on Sat Dec 16 19:50:57 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> IMPURITY