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Details

Stereochemistry ACHIRAL
Molecular Formula C14H17N2O2S.Br
Molecular Weight 357.266
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of N,N-dimethyl-1-(4-methylphenyl)sulfonylpyridin-1-ium-4-amine bromide

SMILES

[Br-].CN(C)C1=CC=[N+](C=C1)S(=O)(=O)C2=CC=C(C)C=C2

InChI

InChIKey=AUNHKTAYBDKWBC-UHFFFAOYSA-M
InChI=1S/C14H17N2O2S.BrH/c1-12-4-6-14(7-5-12)19(17,18)16-10-8-13(9-11-16)15(2)3;/h4-11H,1-3H3;1H/q+1;/p-1

HIDE SMILES / InChI

Molecular Formula Br
Molecular Weight 79.904
Charge -1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C14H17N2O2S
Molecular Weight 277.362
Charge 1
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 Wed Apr 02 19:37:29 GMT 2025
Edited
by admin
on Wed Apr 02 19:37:29 GMT 2025
Record UNII
X46T42E9UN
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Pyridinium, 4-(dimethylamino)-1-[(4-methylphenyl)sulfonyl]-, bromide
Preferred Name English
N,N-dimethyl-1-(4-methylphenyl)sulfonylpyridin-1-ium-4-amine bromide
Systematic Name English
Pyridinium, 4-(dimethylamino)-1-[(4-methylphenyl)sulfonyl]-, bromide (1:1)
Systematic Name English
Code System Code Type Description
FDA UNII
X46T42E9UN
Created by admin on Wed Apr 02 19:37:29 GMT 2025 , Edited by admin on Wed Apr 02 19:37:29 GMT 2025
PRIMARY
CAS
71483-08-4
Created by admin on Wed Apr 02 19:37:29 GMT 2025 , Edited by admin on Wed Apr 02 19:37:29 GMT 2025
PRIMARY
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