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Details

Stereochemistry ACHIRAL
Molecular Formula C23H24ClN3O5S.ClH
Molecular Weight 526.433
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-[1-[4-(5-Chloro-1,1-dioxido-3-oxo-1,2-benzisothiazol-2(3H)-yl)butyl]-4-piperidinyl]-2(3H)-benzoxazolone hydrochloride

SMILES

Cl.ClC1=CC2=C(C=C1)S(=O)(=O)N(CCCCN3CCC(CC3)N4C(=O)OC5=C4C=CC=C5)C2=O

InChI

InChIKey=SYPVZTVWOAYBMJ-UHFFFAOYSA-N
InChI=1S/C23H24ClN3O5S.ClH/c24-16-7-8-21-18(15-16)22(28)26(33(21,30)31)12-4-3-11-25-13-9-17(10-14-25)27-19-5-1-2-6-20(19)32-23(27)29;/h1-2,5-8,15,17H,3-4,9-14H2;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 C23H24ClN3O5S
Molecular Weight 489.972
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 11:59:26 GMT 2025
Edited
by admin
on Wed Apr 02 11:59:26 GMT 2025
Record UNII
WZ55ZQ8B4H
Record Status Validated (UNII)
Record Version
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Name Type Language
3-[1-[4-(5-Chloro-1,1-dioxido-3-oxo-1,2-benzisothiazol-2(3H)-yl)butyl]-4-piperidinyl]-2(3H)-benzoxazolone hydrochloride
Systematic Name English
2(3H)-Benzoxazolone, 3-[1-[4-(5-chloro-1,1-dioxido-3-oxo-1,2-benzisothiazol-2(3H)-yl)butyl]-4-piperidinyl]-, hydrochloride
Preferred Name English
2(3H)-Benzoxazolone, 3-[1-[4-(5-chloro-1,1-dioxido-3-oxo-1,2-benzisothiazol-2(3H)-yl)butyl]-4-piperidinyl]-, monohydrochloride
Systematic Name English
Code System Code Type Description
CAS
173843-24-8
Created by admin on Wed Apr 02 11:59:26 GMT 2025 , Edited by admin on Wed Apr 02 11:59:26 GMT 2025
PRIMARY
FDA UNII
WZ55ZQ8B4H
Created by admin on Wed Apr 02 11:59:26 GMT 2025 , Edited by admin on Wed Apr 02 11:59:26 GMT 2025
PRIMARY
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