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Details

Stereochemistry ACHIRAL
Molecular Formula C26H30N2O5S2.ClH
Molecular Weight 551.118
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of AR-C69457AA MONOHYDROCHLORIDE

SMILES

Cl.OC1=CC=C(CCNCCCS(=O)(=O)CCOCCC2=CC=CC3=C2C=CC=C3)C4=C1NC(=O)S4

InChI

InChIKey=UGMCZQLEPGUBSE-UHFFFAOYSA-N
InChI=1S/C26H30N2O5S2.ClH/c29-23-10-9-21(25-24(23)28-26(30)34-25)11-14-27-13-4-17-35(31,32)18-16-33-15-12-20-7-3-6-19-5-1-2-8-22(19)20;/h1-3,5-10,27,29H,4,11-18H2,(H,28,30);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 C26H30N2O5S2
Molecular Weight 514.657
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 01:41:15 GMT 2023
Edited
by admin
on Sat Dec 16 01:41:15 GMT 2023
Record UNII
W53G5D88SA
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
AR-C69457AA MONOHYDROCHLORIDE
Common Name English
4-HYDROXY-7-(2-(3-(2-(2-(1-NAPHTHYL)ETHOXY)ETHYLSULFONYL)PROPYLAMINO)ETHYL)-3H-1,3-BENZOTHIAZOL-2-ONE HYDROCHLORIDE
Systematic Name English
2(3H)-BENZOTHIAZOLONE, 4-HYDROXY-7-(2-((3-((2-(2-(1-NAPHTHALENYL)ETHOXY)ETHYL)SULFONYL)PROPYL)AMINO)ETHYL)-, HYDROCHLORIDE (1:1)
Systematic Name English
Code System Code Type Description
CAS
193070-83-6
Created by admin on Sat Dec 16 01:41:15 GMT 2023 , Edited by admin on Sat Dec 16 01:41:15 GMT 2023
PRIMARY
PUBCHEM
9829024
Created by admin on Sat Dec 16 01:41:15 GMT 2023 , Edited by admin on Sat Dec 16 01:41:15 GMT 2023
PRIMARY
FDA UNII
W53G5D88SA
Created by admin on Sat Dec 16 01:41:15 GMT 2023 , Edited by admin on Sat Dec 16 01:41:15 GMT 2023
PRIMARY
Related Record Type Details
ACTIVE MOIETY