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Details

Stereochemistry ABSOLUTE
Molecular Formula C16H17ClN2OS.ClH
Molecular Weight 357.298
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ENCENICLINE HYDROCHLORIDE

SMILES

Cl.ClC1=CC=CC2=C1SC(=C2)C(=O)N[C@H]3CN4CCC3CC4

InChI

InChIKey=OIJYTJGIDVTCFF-ZOWNYOTGSA-N
InChI=1S/C16H17ClN2OS.ClH/c17-12-3-1-2-11-8-14(21-15(11)12)16(20)18-13-9-19-6-4-10(13)5-7-19;/h1-3,8,10,13H,4-7,9H2,(H,18,20);1H/t13-;/m0./s1

HIDE SMILES / InChI
Molecular Formula C16H17ClN2OS
Molecular Weight 320.837
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED
Molecular Formula ClH
Molecular Weight 36.461
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Unknown
86413
Substance Class Chemical
Created
by admin
on Sat Dec 16 09:46:38 UTC 2023
Edited
by admin
on Sat Dec 16 09:46:38 UTC 2023
Record UNII
VYV1YE9W06
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ENCENICLINE HYDROCHLORIDE
USAN   WHO-DD  
USAN  
Official Name English
BENZO(B)THIOPHENE-2-CARBOXAMIDE, N-(3R)-1-AZABICYCLO(2.2.2)OCT-3-YL-7-CHLORO-, HYDROCHLORIDE (1:1)
Systematic Name English
ENCENICLINE HYDROCHLORIDE [USAN]
Common Name English
BENZO(B)THIOPHENE-2-CARBOXAMIDE, N-(3R)-1-AZABICYCLO(2.2.2)OCT-3-YL-7-CHLORO-, MONOHYDROCHLORIDE
Systematic Name English
(R)-7-CHLORO-N-(QUINUCLIDIN-3-YL)BENZO(B)THIOPHENE-2-CARBOXAMIDE HYDROCHLORIDE
Systematic Name English
N-[(3R)-1-Azabicyclo[2.2.2]oct-3-yl]-7-chloro-1-benzothiophene-2-carboxamide monohydrochloride
Systematic Name English
EVP-6124 HYDROCHLORIDE
Code English
Encenicline hydrochloride [WHO-DD]
Common Name English
Code System Code Type Description
CAS
550999-74-1
Created by admin on Sat Dec 16 09:46:39 UTC 2023 , Edited by admin on Sat Dec 16 09:46:39 UTC 2023
PRIMARY
FDA UNII
VYV1YE9W06
Created by admin on Sat Dec 16 09:46:39 UTC 2023 , Edited by admin on Sat Dec 16 09:46:39 UTC 2023
PRIMARY
ChEMBL
CHEMBL2151572
Created by admin on Sat Dec 16 09:46:39 UTC 2023 , Edited by admin on Sat Dec 16 09:46:39 UTC 2023
PRIMARY
SMS_ID
300000044458
Created by admin on Sat Dec 16 09:46:39 UTC 2023 , Edited by admin on Sat Dec 16 09:46:39 UTC 2023
PRIMARY
USAN
ZZ-157
Created by admin on Sat Dec 16 09:46:39 UTC 2023 , Edited by admin on Sat Dec 16 09:46:39 UTC 2023
PRIMARY
NCI_THESAURUS
C169947
Created by admin on Sat Dec 16 09:46:39 UTC 2023 , Edited by admin on Sat Dec 16 09:46:39 UTC 2023
PRIMARY
PUBCHEM
46208542
Created by admin on Sat Dec 16 09:46:39 UTC 2023 , Edited by admin on Sat Dec 16 09:46:39 UTC 2023
PRIMARY
EPA CompTox
DTXSID40673090
Created by admin on Sat Dec 16 09:46:39 UTC 2023 , Edited by admin on Sat Dec 16 09:46:39 UTC 2023
PRIMARY
DRUG BANK
DBSALT002058
Created by admin on Sat Dec 16 09:46:39 UTC 2023 , Edited by admin on Sat Dec 16 09:46:39 UTC 2023
PRIMARY
Related Record Type Details
Structure of ENCENICLINE
PARENT -> SALT/SOLVATE
Structure of ENCENICLINE HYDROCHLORIDE MONOHYDRATE
SOLVATE->ANHYDROUS
Related Record Type Details
Structure of ENCENICLINE
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