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

Details

Stereochemistry ACHIRAL
Molecular Formula C21H27N3O.ClH
Molecular Weight 373.92
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of METODESNITAZENE HYDROCHLORIDE

SMILES

Cl.CCN(CC)CCN1C(CC2=CC=C(OC)C=C2)=NC3=CC=CC=C13

InChI

InChIKey=IOQZPMOVWNEIKR-UHFFFAOYSA-N
InChI=1S/C21H27N3O.ClH/c1-4-23(5-2)14-15-24-20-9-7-6-8-19(20)22-21(24)16-17-10-12-18(25-3)13-11-17;/h6-13H,4-5,14-16H2,1-3H3;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 C21H27N3O
Molecular Weight 337.4586
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 18:59:46 UTC 2023
Edited
by admin
on Sat Dec 16 18:59:46 UTC 2023
Record UNII
CVT3V45AN4
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
METODESNITAZENE HYDROCHLORIDE
Common Name English
METODESNITAZENE (HYDROCHLORIDE)
Common Name English
METAZENE HYDROCHLORIDE
Common Name English
1H-BENZIMIDAZOLE-1-ETHANAMINE, N,N-DIETHYL-2-((4-METHOXYPHENYL)METHYL)-, HYDROCHLORIDE
Systematic Name English
N,N-DIETHYL-2-((4-METHOXYPHENYL)METHYL)-1H-BENZIMIDAZOLE-1-ETHANAMINE, HYDROCHLORIDE
Systematic Name English
Code System Code Type Description
FDA UNII
CVT3V45AN4
Created by admin on Sat Dec 16 18:59:46 UTC 2023 , Edited by admin on Sat Dec 16 18:59:46 UTC 2023
PRIMARY
PUBCHEM
121230195
Created by admin on Sat Dec 16 18:59:46 UTC 2023 , Edited by admin on Sat Dec 16 18:59:46 UTC 2023
PRIMARY
CAS
1071546-40-1
Created by admin on Sat Dec 16 18:59:46 UTC 2023 , Edited by admin on Sat Dec 16 18:59:46 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE
Related Record Type Details
ACTIVE MOIETY