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Details

Stereochemistry ACHIRAL
Molecular Formula C10H8OS
Molecular Weight 176.235
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ETHANONE, 1-BENZO(B)THIEN-2-YL-

SMILES

CC(=O)C1=CC2=CC=CC=C2S1

InChI

InChIKey=SGSGCQGCVKWRNM-UHFFFAOYSA-N
InChI=1S/C10H8OS/c1-7(11)10-6-8-4-2-3-5-9(8)12-10/h2-6H,1H3

HIDE SMILES / InChI

Molecular Formula C10H8OS
Molecular Weight 176.235
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

PubMed

PubMed

TitleDatePubMed
Fragment-based screen against HIV protease.
2010-03
Synthesis and evaluation of 1-(benzo[b]thiophen-2-yl)ethanone analogues as novel anti-osteoporosis agents acting on BMP-2 promotor.
2009-08-01
1-Benzothio-phene-2-carbaldehyde 4-ethyl-thio-semicarbazone.
2008-12-20
(E)-2-[1-(1-Benzothio-phen-3-yl)ethyl-idene]hydrazinecarbothio-amide methanol hemisolvate.
2008-05-10
In vitro metabolism of 2-acetylbenzothiophene: relevance to zileuton hepatotoxicity.
2004-02
Patents
Substance Class Chemical
Created
by admin
on Wed Apr 02 07:52:50 GMT 2025
Edited
by admin
on Wed Apr 02 07:52:50 GMT 2025
Record UNII
ZC5EPE32DF
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ETHANONE, 1-BENZO(B)THIEN-2-YL-
Systematic Name English
ZILEUTON RELATED COMPOUND C [USP-RS]
Preferred Name English
Code System Code Type Description
ECHA (EC/EINECS)
245-177-7
Created by admin on Wed Apr 02 07:52:50 GMT 2025 , Edited by admin on Wed Apr 02 07:52:50 GMT 2025
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CAS
22720-75-8
Created by admin on Wed Apr 02 07:52:50 GMT 2025 , Edited by admin on Wed Apr 02 07:52:50 GMT 2025
PRIMARY
RS_ITEM_NUM
1724689
Created by admin on Wed Apr 02 07:52:50 GMT 2025 , Edited by admin on Wed Apr 02 07:52:50 GMT 2025
PRIMARY
PUBCHEM
89805
Created by admin on Wed Apr 02 07:52:50 GMT 2025 , Edited by admin on Wed Apr 02 07:52:50 GMT 2025
PRIMARY
FDA UNII
ZC5EPE32DF
Created by admin on Wed Apr 02 07:52:50 GMT 2025 , Edited by admin on Wed Apr 02 07:52:50 GMT 2025
PRIMARY
EPA CompTox
DTXSID3057692
Created by admin on Wed Apr 02 07:52:50 GMT 2025 , Edited by admin on Wed Apr 02 07:52:50 GMT 2025
PRIMARY