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Details

Stereochemistry ACHIRAL
Molecular Formula C18H20F2N4O2S.ClH
Molecular Weight 430.9
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1-(2,6-DIFLUOROPHENYL)-3-(2-PIPERAZIN-1-YLETHYL)-1,3-DIHYDRO-2,1,3-BENZOTHIADIAZOLE 2,2-DIOXIDE MONOHYDROCHLORIDE

SMILES

Cl.FC1=CC=CC(F)=C1N2C3=C(C=CC=C3)N(CCN4CCNCC4)S2(=O)=O

InChI

InChIKey=WZYNILHOKGNAMR-UHFFFAOYSA-N
InChI=1S/C18H20F2N4O2S.ClH/c19-14-4-3-5-15(20)18(14)24-17-7-2-1-6-16(17)23(27(24,25)26)13-12-22-10-8-21-9-11-22;/h1-7,21H,8-13H2;1H

HIDE SMILES / InChI

Molecular Formula C18H20F2N4O2S
Molecular Weight 394.439
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 Sat Dec 16 18:41:25 GMT 2023
Edited
by admin
on Sat Dec 16 18:41:25 GMT 2023
Record UNII
HD7XVD6FH8
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1-(2,6-DIFLUOROPHENYL)-3-(2-PIPERAZIN-1-YLETHYL)-1,3-DIHYDRO-2,1,3-BENZOTHIADIAZOLE 2,2-DIOXIDE MONOHYDROCHLORIDE
Systematic Name English
2,1,3-BENZOTHIADIAZOLE, 1-(2,6-DIFLUOROPHENYL)-1,3-DIHYDRO-3-(2-(1-PIPERAZINYL)ETHYL)-, 2,2-DIOXIDE, HYDROCHLORIDE (1:1)
Systematic Name English
Code System Code Type Description
FDA UNII
HD7XVD6FH8
Created by admin on Sat Dec 16 18:41:25 GMT 2023 , Edited by admin on Sat Dec 16 18:41:25 GMT 2023
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CAS
1233485-19-2
Created by admin on Sat Dec 16 18:41:25 GMT 2023 , Edited by admin on Sat Dec 16 18:41:25 GMT 2023
PRIMARY
PUBCHEM
163203514
Created by admin on Sat Dec 16 18:41:25 GMT 2023 , Edited by admin on Sat Dec 16 18:41:25 GMT 2023
PRIMARY