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Details

Stereochemistry ABSOLUTE
Molecular Formula C16H17ClN2OS.ClH.H2O
Molecular Weight 375.313
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ENCENICLINE HYDROCHLORIDE MONOHYDRATE

SMILES

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

InChI

InChIKey=OYFJBYJMAHEUQV-GXKRWWSZSA-N
InChI=1S/C16H17ClN2OS.ClH.H2O/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;1H2/t13-;;/m0../s1

HIDE SMILES / InChI

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

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 H2O
Molecular Weight 18.0153
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 08:03:04 UTC 2023
Edited
by admin
on Sat Dec 16 08:03:04 UTC 2023
Record UNII
9201D24ZB5
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ENCENICLINE HYDROCHLORIDE MONOHYDRATE
Common Name English
ENCENICLINE HYDROCHLORIDE HYDRATE [JAN]
Common Name English
EVP-6124 HYDROCHLORIDE MONOHYDRATE
Common Name English
ENCENICLINE HYDROCHLORIDE HYDRATE
Common Name English
BENZO(B)THIOPHENE-2-CARBOXAMIDE, N-(3R)-1-AZABICYCLO(2.2.2)OCT-3-YL-7-CHLORO-, HYDROCHLORIDE, HYDRATE (1:1:1)
Systematic Name English
(R)-7-CHLORO-N-(QUINUCLIDIN-3-YL)BENZO(B)THIOPHENE-2-CARBOXAMIDE HYDROCHLORIDE MONOHYDRATE
Systematic Name English
Code System Code Type Description
SMS_ID
300000042514
Created by admin on Sat Dec 16 08:03:04 UTC 2023 , Edited by admin on Sat Dec 16 08:03:04 UTC 2023
PRIMARY
FDA UNII
9201D24ZB5
Created by admin on Sat Dec 16 08:03:04 UTC 2023 , Edited by admin on Sat Dec 16 08:03:04 UTC 2023
PRIMARY
PUBCHEM
54597188
Created by admin on Sat Dec 16 08:03:04 UTC 2023 , Edited by admin on Sat Dec 16 08:03:04 UTC 2023
PRIMARY
CAS
1350343-61-1
Created by admin on Sat Dec 16 08:03:04 UTC 2023 , Edited by admin on Sat Dec 16 08:03:04 UTC 2023
PRIMARY
Related Record Type Details
ANHYDROUS->SOLVATE
Related Record Type Details
ACTIVE MOIETY