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Details

Stereochemistry MIXED
Molecular Formula C18H22NO3S.Br
Molecular Weight 412.341
Optical Activity UNSPECIFIED
Defined Stereocenters 0 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of HETERONIUM BROMIDE

SMILES

[Br-].C[N+]1(C)CCC(C1)OC(=O)C(O)(C2=CC=CS2)C3=CC=CC=C3

InChI

InChIKey=SHPIBZXFYWMQBR-UHFFFAOYSA-M
InChI=1S/C18H22NO3S.BrH/c1-19(2)11-10-15(13-19)22-17(20)18(21,16-9-6-12-23-16)14-7-4-3-5-8-14;/h3-9,12,15,21H,10-11,13H2,1-2H3;1H/q+1;/p-1

HIDE SMILES / InChI
Molecular Formula BrH
Molecular Weight 80.912
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE
Molecular Formula C18H21NO3S
Molecular Weight 331.429
Charge 0
Count
Stereochemistry MIXED
Additional Stereochemistry No
Defined Stereocenters 0 / 3
E/Z Centers 0
Optical Activity UNSPECIFIED

Description

Heteronium is an anticholinergic agent. As a bromide salt, it was investigated in the clinic for the treatment of peptic ulcer and other gastrointestinal disorders.

Approval Year

Unknown
149124
PubMed

PubMed

TitleDatePubMed
Evaluation of the antisecretory effect of a new anticholinergic agent--heteronium bromide.
1969-05
A double-blind study of heteronium bromide and amobarbital in the management of gastrointestinal conditions associated with anxiety.
1968-10
Substance Class Chemical
Created
by admin
on Mon Mar 31 18:44:26 GMT 2025
Edited
by admin
on Mon Mar 31 18:44:26 GMT 2025
Record UNII
B41610WX8O
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
31814
Preferred Name English
HETERONIUM BROMIDE
INN   MI   USAN  
INN   USAN  
Official Name English
HETERONIUM BROMIDE [USAN]
Common Name English
.ALPHA.+.BETA.-(±)-(1-METHYL-3-PYRROLIDINYL) .ALPHA.-PHENYL-.ALPHA.-(2-THIENYL)GLYCOLATE METHOBROMIDE
Common Name English
heteronium bromide [INN]
Common Name English
PYRROLIDINIUM, 3-((2-HYDROXY-2-PHENYL-2-(2-THIENYL)ACETYL)OXY)-1,1-DIMETHYL-, BROMIDE (1:1)
Systematic Name English
HETERONIUM BROMIDE [MI]
Common Name English
PYRROLIDINIUM, 3-((HYDROXYPHENYL-2-THIENYLACETYL)OXY)-1,1-DIMETHYL-, BROMIDE
Systematic Name English
(±)-HETERONIUM BROMIDE
Common Name English
(±)-3-HYDROXY-1,1-DIMETHYLPYRROLIDINIUM BROMIDE .ALPHA.-PHENYL-2-THIOPHENEGLYCOLATE
Systematic Name English
HETRUM BROMIDE
Common Name English
Code System Code Type Description
NCI_THESAURUS
C174630
Created by admin on Mon Mar 31 18:44:27 GMT 2025 , Edited by admin on Mon Mar 31 18:44:27 GMT 2025
PRIMARY
ChEMBL
CHEMBL2110853
Created by admin on Mon Mar 31 18:44:26 GMT 2025 , Edited by admin on Mon Mar 31 18:44:26 GMT 2025
PRIMARY
FDA UNII
B41610WX8O
Created by admin on Mon Mar 31 18:44:27 GMT 2025 , Edited by admin on Mon Mar 31 18:44:27 GMT 2025
PRIMARY
EPA CompTox
DTXSID20993288
Created by admin on Mon Mar 31 18:44:27 GMT 2025 , Edited by admin on Mon Mar 31 18:44:27 GMT 2025
PRIMARY
CAS
7247-57-6
Created by admin on Mon Mar 31 18:44:26 GMT 2025 , Edited by admin on Mon Mar 31 18:44:26 GMT 2025
PRIMARY
INN
1628
Created by admin on Mon Mar 31 18:44:26 GMT 2025 , Edited by admin on Mon Mar 31 18:44:26 GMT 2025
PRIMARY
EVMPD
SUB08022MIG
Created by admin on Mon Mar 31 18:44:26 GMT 2025 , Edited by admin on Mon Mar 31 18:44:26 GMT 2025
PRIMARY
MESH
C014023
Created by admin on Mon Mar 31 18:44:26 GMT 2025 , Edited by admin on Mon Mar 31 18:44:26 GMT 2025
PRIMARY
SMS_ID
100000083952
Created by admin on Mon Mar 31 18:44:27 GMT 2025 , Edited by admin on Mon Mar 31 18:44:27 GMT 2025
PRIMARY
PUBCHEM
13964
Created by admin on Mon Mar 31 18:44:27 GMT 2025 , Edited by admin on Mon Mar 31 18:44:27 GMT 2025
PRIMARY
MERCK INDEX
m230
Created by admin on Mon Mar 31 18:44:26 GMT 2025 , Edited by admin on Mon Mar 31 18:44:26 GMT 2025
PRIMARY Merck Index
Related Record Type Details
Structure of HETERONIUM
ACTIVE MOIETY
NIH
NCATS
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