5-[2-[4-[[5-(azidomethyl)-2-butyl-4-chloroimidazol-1-yl]methyl]phenyl]phenyl]-2H-tetrazole

Details

Stereochemistry	ACHIRAL
Molecular Formula	C22H22ClN9
Molecular Weight	447.923
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure of 5-[2-[4-[[5-(azidomethyl)-2-butyl-4-chloroimidazol-1-yl]methyl]phenyl]phenyl]-2H-tetrazole

Structure Search

SMILES

CCCCC1=NC(Cl)=C(CN=[N+]=[N-])N1CC2=CC=C(C=C2)C3=C(C=CC=C3)C4=NN=NN4

InChI

InChIKey=WSECDZBYSJWHFL-UHFFFAOYSA-N

InChI=1S/C22H22ClN9/c1-2-3-8-20-26-21(23)19(13-25-29-24)32(20)14-15-9-11-16(12-10-15)17-6-4-5-7-18(17)22-27-30-31-28-22/h4-7,9-12H,2-3,8,13-14H2,1H3,(H,27,28,30,31)

HIDE SMILES / InChI

Molecular Formula	C22H22ClN9
Molecular Weight	447.923
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	1
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Wed Apr 02 15:20:48 GMT 2025` Edited by `admin` on `Wed Apr 02 15:20:48 GMT 2025`
Record UNII	6QUU26LZ5H
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

1H-Tetrazole, 5-[4?-[[5-(azidomethyl)-2-butyl-4-chloro-1H-imidazol-1-yl]methyl][1,1?-biphenyl]-2-yl]-

Preferred Name

English

5-[2-[4-[[5-(azidomethyl)-2-butyl-4-chloroimidazol-1-yl]methyl]phenyl]phenyl]-2H-tetrazole

Systematic Name

English

5-[4?-[[5-(Azidomethyl)-2-butyl-4-chloro-1H-imidazol-1-yl]methyl][1,1?-biphenyl]-2-yl]-2H-tetrazole

Systematic Name

English

2H-Tetrazole, 5-[4?-[[5-(azidomethyl)-2-butyl-4-chloro-1H-imidazol-1-yl]methyl][1,1?-biphenyl]-2-yl]-

Systematic Name

English

Code System Code Type Description

CAS

727718-93-6

Created by admin on Wed Apr 02 15:20:48 GMT 2025 , Edited by admin on Wed Apr 02 15:20:48 GMT 2025

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FDA UNII

6QUU26LZ5H

Created by admin on Wed Apr 02 15:20:48 GMT 2025 , Edited by admin on Wed Apr 02 15:20:48 GMT 2025

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PUBCHEM

58773826

Created by admin on Wed Apr 02 15:20:48 GMT 2025 , Edited by admin on Wed Apr 02 15:20:48 GMT 2025

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