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Details

Stereochemistry ACHIRAL
Molecular Formula C18H23N2OS.I
Molecular Weight 442.357
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of 1,6-Dimethyl-2-[2-(methylthio)-2-(4-morpholinyl)ethenyl]quinolinium iodide

SMILES

[I-].CSC(=CC1=CC=C2C=C(C)C=CC2=[N+]1C)N3CCOCC3

InChI

InChIKey=ZZDZIWNAVJIFOL-UHFFFAOYSA-M
InChI=1S/C18H23N2OS.HI/c1-14-4-7-17-15(12-14)5-6-16(19(17)2)13-18(22-3)20-8-10-21-11-9-20;/h4-7,12-13H,8-11H2,1-3H3;1H/q+1;/p-1

HIDE SMILES / InChI

Molecular Formula I
Molecular Weight 126.90447
Charge -1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C18H23N2OS
Molecular Weight 315.453
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 Tue Apr 01 19:39:26 GMT 2025
Edited
by admin
on Tue Apr 01 19:39:26 GMT 2025
Record UNII
DDH34C35US
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1,6-Dimethyl-2-[2-(methylthio)-2-(4-morpholinyl)ethenyl]quinolinium iodide
Systematic Name English
NSC-316720
Preferred Name English
QUINOLINIUM, 1,6-DIMETHYL-2-(2-(METHYLTHIO)-2-(4-MORPHOLINYL)ETHENYL)-, IODIDE
Systematic Name English
Quinolinium, 1,6-dimethyl-2-[2-(methylthio)-2-(4-morpholinyl)ethenyl]-, iodide (1:1)
Systematic Name English
Code System Code Type Description
PUBCHEM
6439785
Created by admin on Tue Apr 01 19:39:26 GMT 2025 , Edited by admin on Tue Apr 01 19:39:26 GMT 2025
PRIMARY
FDA UNII
DDH34C35US
Created by admin on Tue Apr 01 19:39:26 GMT 2025 , Edited by admin on Tue Apr 01 19:39:26 GMT 2025
PRIMARY
NSC
316720
Created by admin on Tue Apr 01 19:39:26 GMT 2025 , Edited by admin on Tue Apr 01 19:39:26 GMT 2025
PRIMARY
EPA CompTox
DTXSID60995327
Created by admin on Tue Apr 01 19:39:26 GMT 2025 , Edited by admin on Tue Apr 01 19:39:26 GMT 2025
PRIMARY
CAS
74020-12-5
Created by admin on Tue Apr 01 19:39:26 GMT 2025 , Edited by admin on Tue Apr 01 19:39:26 GMT 2025
PRIMARY