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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

Molecular Formula C21H20ClNS
Molecular Weight 353.908
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 1
Optical Activity ( + / - )

Patents
Substance Class Chemical
Created
by admin
on Fri Dec 15 16:06:38 GMT 2023
Edited
by admin
on Fri Dec 15 16:06:38 GMT 2023
Record UNII
6DTQ2MGV34
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
NUCLOTIXENE
INN  
INN  
Official Name English
LM 21005
Code 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 Fri Dec 15 16:06:38 GMT 2023 , Edited by admin on Fri Dec 15 16:06:38 GMT 2023
Code System Code Type Description
EVMPD
SUB09389MIG
Created by admin on Fri Dec 15 16:06:38 GMT 2023 , Edited by admin on Fri Dec 15 16:06:38 GMT 2023
PRIMARY
FDA UNII
6DTQ2MGV34
Created by admin on Fri Dec 15 16:06:38 GMT 2023 , Edited by admin on Fri Dec 15 16:06:38 GMT 2023
PRIMARY
CAS
36471-39-3
Created by admin on Fri Dec 15 16:06:38 GMT 2023 , Edited by admin on Fri Dec 15 16:06:38 GMT 2023
PRIMARY
PUBCHEM
166584
Created by admin on Fri Dec 15 16:06:38 GMT 2023 , Edited by admin on Fri Dec 15 16:06:38 GMT 2023
PRIMARY
NCI_THESAURUS
C81481
Created by admin on Fri Dec 15 16:06:38 GMT 2023 , Edited by admin on Fri Dec 15 16:06:38 GMT 2023
PRIMARY
INN
3868
Created by admin on Fri Dec 15 16:06:38 GMT 2023 , Edited by admin on Fri Dec 15 16:06:38 GMT 2023
PRIMARY
ChEMBL
CHEMBL2106831
Created by admin on Fri Dec 15 16:06:38 GMT 2023 , Edited by admin on Fri Dec 15 16:06:38 GMT 2023
PRIMARY
SMS_ID
100000083607
Created by admin on Fri Dec 15 16:06:38 GMT 2023 , Edited by admin on Fri Dec 15 16:06:38 GMT 2023
PRIMARY
EPA CompTox
DTXSID00865818
Created by admin on Fri Dec 15 16:06:38 GMT 2023 , Edited by admin on Fri Dec 15 16:06:38 GMT 2023
PRIMARY
Related Record Type Details
ACTIVE MOIETY