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

Details

Stereochemistry ACHIRAL
Molecular Formula C11H10NS.Br
Molecular Weight 268.173
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of 1-[2-(2-Thienyl)vinyl]pyridinium bromide

SMILES

[Br-].S1C=CC=C1\C=C\[N+]2=CC=CC=C2

InChI

InChIKey=SIUOIWNYIUYMGA-MLBSPLJJSA-M
InChI=1S/C11H10NS.BrH/c1-2-7-12(8-3-1)9-6-11-5-4-10-13-11;/h1-10H;1H/q+1;/p-1/b9-6+;

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 C11H10NS
Molecular Weight 188.269
Charge 1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 12:39:16 GMT 2023
Edited
by admin
on Sat Dec 16 12:39:16 GMT 2023
Record UNII
6M97GRF5BA
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1-[2-(2-Thienyl)vinyl]pyridinium bromide
Systematic Name English
1-[(E)-2-thiophen-2-ylethenyl]pyridin-1-ium bromide
Systematic Name English
THIENPYDIN
Common Name English
Pyridinium, 1-[2-(2-thienyl)ethenyl]-, bromide (1:1)
Systematic Name English
Pyridinium, 1-[2-(2-thienyl)ethenyl]-, bromide
Systematic Name English
trans-1-[2-(2-Thienyl)vinyl]pyridinium bromide
Systematic Name English
NSC-405305
Code English
Pyridinium, 1-[2-(2-thienyl)ethenyl]-, bromide, (E)-
Systematic Name English
Code System Code Type Description
CAS
26155-11-3
Created by admin on Sat Dec 16 12:39:16 GMT 2023 , Edited by admin on Sat Dec 16 12:39:16 GMT 2023
PRIMARY
CAS
7496-62-0
Created by admin on Sat Dec 16 12:39:16 GMT 2023 , Edited by admin on Sat Dec 16 12:39:16 GMT 2023
NON-SPECIFIC STEREOCHEMISTRY
FDA UNII
6M97GRF5BA
Created by admin on Sat Dec 16 12:39:16 GMT 2023 , Edited by admin on Sat Dec 16 12:39:16 GMT 2023
PRIMARY
NSC
405305
Created by admin on Sat Dec 16 12:39:16 GMT 2023 , Edited by admin on Sat Dec 16 12:39:16 GMT 2023
PRIMARY
PUBCHEM
6444197
Created by admin on Sat Dec 16 12:39:16 GMT 2023 , Edited by admin on Sat Dec 16 12:39:16 GMT 2023
PRIMARY
Related Record Type Details
SALT/SOLVATE -> PARENT