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Details

Stereochemistry ACHIRAL
Molecular Formula C14H17N2S.I
Molecular Weight 372.268
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1-(3-INDOLYL(METHYLTHIO)METHYLENE)PYRROLIDINIUM IODIDE

SMILES

[I-].CSC(C1=CNC2=C1C=CC=C2)=[N+]3CCCC3

InChI

InChIKey=IUBLTMLHKZCPDU-UHFFFAOYSA-N
InChI=1S/C14H16N2S.HI/c1-17-14(16-8-4-5-9-16)12-10-15-13-7-3-2-6-11(12)13;/h2-3,6-7,10H,4-5,8-9H2,1H3;1H

HIDE SMILES / InChI

Approval Year

Unknown
149124
Name Type Language
1-(3-INDOLYL(METHYLTHIO)METHYLENE)PYRROLIDINIUM IODIDE
Systematic Name English
PYRROLIDINIUM, 1-(1H-INDOL-3-YL(METHYLTHIO)METHYLENE)-, IODIDE
Preferred Name English
PYRROLIDINIUM, 1-(1H-INDOL-3-YL(METHYLTHIO)METHYLENE)-, IODIDE (1:1)
Systematic Name English
1-(3-INDOLYL(METHYLTHIO)METHYLENE) PYRROLIDINIUM IODIDE
Systematic Name English
PYRROLIDINIUM, 1-(3-INDOLYL(METHYLTHIO)METHYLENE)-, IODIDE
Systematic Name English
Code System Code Type Description
PUBCHEM
21118370
Created by admin on Mon Mar 31 18:52:58 GMT 2025 , Edited by admin on Mon Mar 31 18:52:58 GMT 2025
PRIMARY
FDA UNII
N4W8KE1723
Created by admin on Mon Mar 31 18:52:58 GMT 2025 , Edited by admin on Mon Mar 31 18:52:58 GMT 2025
PRIMARY
EPA CompTox
DTXSID10970260
Created by admin on Mon Mar 31 18:52:58 GMT 2025 , Edited by admin on Mon Mar 31 18:52:58 GMT 2025
PRIMARY
CAS
54921-50-5
Created by admin on Mon Mar 31 18:52:58 GMT 2025 , Edited by admin on Mon Mar 31 18:52:58 GMT 2025
PRIMARY
NIH
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