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

Details

Stereochemistry ACHIRAL
Molecular Formula C25H32N2O6S
Molecular Weight 488.596
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of N-(2-BUTYL-3-(4-(3-(2-HYDROXYETHYLAMINO)PROPOXY)BENZOYL)BENZOFURAN-5-YL)METHANESULFONAMIDE

SMILES

CCCCC1=C(C(=O)C2=CC=C(OCCCNCCO)C=C2)C3=CC(NS(C)(=O)=O)=CC=C3O1

InChI

InChIKey=LPPNADYXRQBKCA-UHFFFAOYSA-N
InChI=1S/C25H32N2O6S/c1-3-4-6-23-24(21-17-19(27-34(2,30)31)9-12-22(21)33-23)25(29)18-7-10-20(11-8-18)32-16-5-13-26-14-15-28/h7-12,17,26-28H,3-6,13-16H2,1-2H3

HIDE SMILES / InChI

Molecular Formula C25H32N2O6S
Molecular Weight 488.596
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 14:59:11 GMT 2023
Edited
by admin
on Sat Dec 16 14:59:11 GMT 2023
Record UNII
V4SVV994JM
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
N-(2-BUTYL-3-(4-(3-(2-HYDROXYETHYLAMINO)PROPOXY)BENZOYL)BENZOFURAN-5-YL)METHANESULFONAMIDE
Systematic Name English
DRONEDARONE METABOLITE H21
Common Name English
Code System Code Type Description
PUBCHEM
156596605
Created by admin on Sat Dec 16 14:59:12 GMT 2023 , Edited by admin on Sat Dec 16 14:59:12 GMT 2023
PRIMARY
FDA UNII
V4SVV994JM
Created by admin on Sat Dec 16 14:59:12 GMT 2023 , Edited by admin on Sat Dec 16 14:59:12 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> METABOLITE
FECAL; URINE