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Details

Stereochemistry RACEMIC
Molecular Formula C16H14Cl2N2OS.ClH
Molecular Weight 389.727
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1-(2-(2,4-DICHLOROPHENYL)-2-(THIOPHEN-3-YLMETHOXY)ETHYL)-1H-IMIDAZOLE HYDROCHLORIDE

SMILES

Cl.ClC1=CC=C(C(CN2C=CN=C2)OCC3=CSC=C3)C(Cl)=C1

InChI

InChIKey=CCCQSJHDZKYQKU-UHFFFAOYSA-N
InChI=1S/C16H14Cl2N2OS.ClH/c17-13-1-2-14(15(18)7-13)16(8-20-5-4-19-11-20)21-9-12-3-6-22-10-12;/h1-7,10-11,16H,8-9H2;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 C16H14Cl2N2OS
Molecular Weight 353.266
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 11:12:46 UTC 2023
Edited
by admin
on Sat Dec 16 11:12:46 UTC 2023
Record UNII
C6G5IDN5G6
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1-(2-(2,4-DICHLOROPHENYL)-2-(THIOPHEN-3-YLMETHOXY)ETHYL)-1H-IMIDAZOLE HYDROCHLORIDE
Systematic Name English
1-(2,4-DICHLORO-.BETA.-((3-THENYL)-OXY)PHENETHYL)IMIDAZOLE HYDROCHLORIDE
Systematic Name English
TIOCONAZOLE RELATED COMPOUND A [USP IMPURITY]
Common Name English
TIOCONAZOLE RELATED COMPOUND A [USP-RS]
Common Name English
1H-IMIDAZOLE, 1-(2-(2,4-DICHLOROPHENYL)-2-(3-THIENYLMETHOXY)ETHYL)-, HYDROCHLORIDE (1:1)
Systematic Name English
Code System Code Type Description
FDA UNII
C6G5IDN5G6
Created by admin on Sat Dec 16 11:12:46 UTC 2023 , Edited by admin on Sat Dec 16 11:12:46 UTC 2023
PRIMARY
RS_ITEM_NUM
1667450
Created by admin on Sat Dec 16 11:12:46 UTC 2023 , Edited by admin on Sat Dec 16 11:12:46 UTC 2023
PRIMARY
PUBCHEM
129318796
Created by admin on Sat Dec 16 11:12:46 UTC 2023 , Edited by admin on Sat Dec 16 11:12:46 UTC 2023
PRIMARY
CAS
61709-33-9
Created by admin on Sat Dec 16 11:12:46 UTC 2023 , Edited by admin on Sat Dec 16 11:12:46 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> IMPURITY
CHROMATOGRAPHIC PURITY (HPLC/UV)
USP