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

Details

Stereochemistry RACEMIC
Molecular Formula C21H20ClNS
Molecular Weight 353.908
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of NUCLOTIXENE

SMILES

ClC1=CC2=C(SC3=C(C=CC=C3)C2=CC4CN5CCC4CC5)C=C1

InChI

InChIKey=FCXKKBQJIUTOHH-WOJGMQOQSA-N
InChI=1S/C21H20ClNS/c22-16-5-6-21-19(12-16)18(17-3-1-2-4-20(17)24-21)11-15-13-23-9-7-14(15)8-10-23/h1-6,11-12,14-15H,7-10,13H2/b18-11+

HIDE SMILES / InChI
Patents
Name Type Language
LM 21005
Preferred Name English
NUCLOTIXENE
INN  
INN  
Official Name English
LM-21005
Code English
nuclotixene [INN]
Common Name English
3-((2-CHLOROTHIOXANTHEN-9-YLIDENE)METHYL)QUINUCLIDINE
Systematic Name English
Classification Tree Code System Code
NCI_THESAURUS C265
Created by admin on Mon Mar 31 18:19:16 GMT 2025 , Edited by admin on Mon Mar 31 18:19:16 GMT 2025
Code System Code Type Description
EVMPD
SUB09389MIG
Created by admin on Mon Mar 31 18:19:16 GMT 2025 , Edited by admin on Mon Mar 31 18:19:16 GMT 2025
PRIMARY
FDA UNII
6DTQ2MGV34
Created by admin on Mon Mar 31 18:19:16 GMT 2025 , Edited by admin on Mon Mar 31 18:19:16 GMT 2025
PRIMARY
CAS
36471-39-3
Created by admin on Mon Mar 31 18:19:16 GMT 2025 , Edited by admin on Mon Mar 31 18:19:16 GMT 2025
PRIMARY
PUBCHEM
166584
Created by admin on Mon Mar 31 18:19:16 GMT 2025 , Edited by admin on Mon Mar 31 18:19:16 GMT 2025
PRIMARY
NCI_THESAURUS
C81481
Created by admin on Mon Mar 31 18:19:16 GMT 2025 , Edited by admin on Mon Mar 31 18:19:16 GMT 2025
PRIMARY
INN
3868
Created by admin on Mon Mar 31 18:19:16 GMT 2025 , Edited by admin on Mon Mar 31 18:19:16 GMT 2025
PRIMARY
ChEMBL
CHEMBL2106831
Created by admin on Mon Mar 31 18:19:16 GMT 2025 , Edited by admin on Mon Mar 31 18:19:16 GMT 2025
PRIMARY
SMS_ID
100000083607
Created by admin on Mon Mar 31 18:19:16 GMT 2025 , Edited by admin on Mon Mar 31 18:19:16 GMT 2025
PRIMARY
EPA CompTox
DTXSID00865818
Created by admin on Mon Mar 31 18:19:16 GMT 2025 , Edited by admin on Mon Mar 31 18:19:16 GMT 2025
PRIMARY