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Details

Stereochemistry ACHIRAL
Molecular Formula C25H30ClN5O3.ClH
Molecular Weight 520.451
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Brezivaptan hydrochloride

SMILES

Cl.CC(C)NC(=O)CN1C(=O)N(N=C1C2=CC=CC(Cl)=C2)C3=CC=C(CCN4CCOCC4)C=C3

InChI

InChIKey=YEYNIRFUOXPLDD-UHFFFAOYSA-N
InChI=1S/C25H30ClN5O3.ClH/c1-18(2)27-23(32)17-30-24(20-4-3-5-21(26)16-20)28-31(25(30)33)22-8-6-19(7-9-22)10-11-29-12-14-34-15-13-29;/h3-9,16,18H,10-15,17H2,1-2H3,(H,27,32);1H

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 C25H30ClN5O3
Molecular Weight 483.99
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 Mon Mar 31 22:09:16 GMT 2025
Edited
by admin
on Mon Mar 31 22:09:16 GMT 2025
Record UNII
71UA11023J
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
THY-1773 hydrochloride
Preferred Name English
Brezivaptan hydrochloride
Common Name English
TS-121 hydrochloride
Code English
3-(3-Chlorophenyl)-1,5-dihydro-N-(1-methylethyl)-1-[4-[2-(4-morpholinyl)ethyl]phenyl]-5-oxo-4H-1,2,4-triazole-4-acetamide hydrochloride (1:1)
Systematic Name English
4H-1,2,4-Triazole-4-acetamide, 3-(3-chlorophenyl)-1,5-dihydro-N-(1-methylethyl)-1-[4-[2-(4-morpholinyl)ethyl]phenyl]-5-oxo-, hydrochloride (1:1)
Systematic Name English
Code System Code Type Description
PUBCHEM
89710780
Created by admin on Mon Mar 31 22:09:16 GMT 2025 , Edited by admin on Mon Mar 31 22:09:16 GMT 2025
PRIMARY
CAS
1370446-55-1
Created by admin on Mon Mar 31 22:09:16 GMT 2025 , Edited by admin on Mon Mar 31 22:09:16 GMT 2025
PRIMARY
FDA UNII
71UA11023J
Created by admin on Mon Mar 31 22:09:16 GMT 2025 , Edited by admin on Mon Mar 31 22:09:16 GMT 2025
PRIMARY
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ACTIVE MOIETY