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Details

Stereochemistry ACHIRAL
Molecular Formula C22H26N4O4.ClH
Molecular Weight 446.927
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-((4-Ethoxyphenyl)methyl)-1-(2-(4-morpholinyl)ethyl)-5-nitro-1H-benzimidazole hydrochloride

SMILES

Cl.CCOC1=CC=C(CC2=NC3=C(C=CC(=C3)[N+]([O-])=O)N2CCN4CCOCC4)C=C1

InChI

InChIKey=BATRWXSHPRGOFT-UHFFFAOYSA-N
InChI=1S/C22H26N4O4.ClH/c1-2-30-19-6-3-17(4-7-19)15-22-23-20-16-18(26(27)28)5-8-21(20)25(22)10-9-24-11-13-29-14-12-24;/h3-8,16H,2,9-15H2,1H3;1H

HIDE SMILES / InChI

Molecular Formula C22H26N4O4
Molecular Weight 410.4662
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

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 11:06:46 GMT 2025
Edited
by admin
on Wed Apr 02 11:06:46 GMT 2025
Record UNII
KF9ZZM7XQM
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-((4-Ethoxyphenyl)methyl)-1-(2-(4-morpholinyl)ethyl)-5-nitro-1H-benzimidazole hydrochloride
Systematic Name English
1H-Benzimidazole, 2-[(4-ethoxyphenyl)methyl]-1-[2-(4-morpholinyl)ethyl]-5-nitro-, hydrochloride
Preferred Name English
BENZIMIDAZOLE, 2-(P-ETHOXYBENZYL)-1-(2-MORPHOLINOETHYL)-5-NITRO-, HYDROCHLORIDE
Systematic Name English
Code System Code Type Description
FDA UNII
KF9ZZM7XQM
Created by admin on Wed Apr 02 11:06:46 GMT 2025 , Edited by admin on Wed Apr 02 11:06:46 GMT 2025
PRIMARY
CAS
106801-02-9
Created by admin on Wed Apr 02 11:06:46 GMT 2025 , Edited by admin on Wed Apr 02 11:06:46 GMT 2025
PRIMARY
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