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

Details

Stereochemistry ACHIRAL
Molecular Formula C23H29N3O3S
Molecular Weight 427.56
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-[2-[2-(4-Dibenzo[b,f][1,4]thiazepin-11-yl-1-piperazinyl)ethoxy]ethoxy]ethanol

SMILES

OCCOCCOCCN1CCN(CC1)C2=NC3=C(SC4=C2C=CC=C4)C=CC=C3

InChI

InChIKey=JWFSUEASTFEYFJ-UHFFFAOYSA-N
InChI=1S/C23H29N3O3S/c27-14-16-29-18-17-28-15-13-25-9-11-26(12-10-25)23-19-5-1-3-7-21(19)30-22-8-4-2-6-20(22)24-23/h1-8,27H,9-18H2

HIDE SMILES / InChI

Molecular Formula C23H29N3O3S
Molecular Weight 427.56
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 20:00:51 GMT 2025
Edited
by admin
on Wed Apr 02 20:00:51 GMT 2025
Record UNII
6957V6H5S6
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Ethanol, 2-[2-[2-(4-dibenzo[b,f][1,4]thiazepin-11-yl-1-piperazinyl)ethoxy]ethoxy]-
Preferred Name English
2-[2-[2-(4-Dibenzo[b,f][1,4]thiazepin-11-yl-1-piperazinyl)ethoxy]ethoxy]ethanol
Systematic Name English
Code System Code Type Description
PUBCHEM
10764960
Created by admin on Wed Apr 02 20:00:51 GMT 2025 , Edited by admin on Wed Apr 02 20:00:51 GMT 2025
PRIMARY
FDA UNII
6957V6H5S6
Created by admin on Wed Apr 02 20:00:51 GMT 2025 , Edited by admin on Wed Apr 02 20:00:51 GMT 2025
PRIMARY
CAS
329216-69-5
Created by admin on Wed Apr 02 20:00:51 GMT 2025 , Edited by admin on Wed Apr 02 20:00:51 GMT 2025
PRIMARY