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Details

Stereochemistry RACEMIC
Molecular Formula C19H22N2S.ClH
Molecular Weight 346.917
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Perathiepin hydrochloride

SMILES

Cl.CN1CCN(CC1)C2CC3=CC=CC=C3SC4=CC=CC=C24

InChI

InChIKey=XBUDTNOXCREPIV-UHFFFAOYSA-N
InChI=1S/C19H22N2S.ClH/c1-20-10-12-21(13-11-20)17-14-15-6-2-4-8-18(15)22-19-9-5-3-7-16(17)19;/h2-9,17H,10-14H2,1H3;1H

HIDE SMILES / InChI

Molecular Formula C19H22N2S
Molecular Weight 310.456
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

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

Substance Class Chemical
Created
by admin
on Wed Apr 02 16:03:14 GMT 2025
Edited
by admin
on Wed Apr 02 16:03:14 GMT 2025
Record UNII
TJW4WZK9PP
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Perathiepin hydrochloride
Common Name English
Piperazine, 1-(10,11-dihydrodibenzo[b,f]thiepin-10-yl)-4-methyl-, hydrochloride (1:1)
Preferred Name English
Code System Code Type Description
CAS
1082714-29-1
Created by admin on Wed Apr 02 16:03:14 GMT 2025 , Edited by admin on Wed Apr 02 16:03:14 GMT 2025
PRIMARY
PUBCHEM
164888930
Created by admin on Wed Apr 02 16:03:14 GMT 2025 , Edited by admin on Wed Apr 02 16:03:14 GMT 2025
PRIMARY
FDA UNII
TJW4WZK9PP
Created by admin on Wed Apr 02 16:03:14 GMT 2025 , Edited by admin on Wed Apr 02 16:03:14 GMT 2025
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE