6-CHLORO-4-METHYLBENZO(B)THIOPHEN-3(2H)-ONE

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C9H7ClOS
Molecular Weight	198.669
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 6-CHLORO-4-METHYLBENZO(B)THIOPHEN-3(2H)-ONE

Structure Search

SMILES

CC1=C2C(=O)CSC2=CC(Cl)=C1

InChI

InChIKey=UPPUKRIDAPMTRP-UHFFFAOYSA-N

InChI=1S/C9H7ClOS/c1-5-2-6(10)3-8-9(5)7(11)4-12-8/h2-3H,4H2,1H3

HIDE SMILES / InChI

Molecular Formula	C9H7ClOS
Molecular Weight	198.669
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 `Mon Mar 31 19:39:50 GMT 2025` Edited by `admin` on `Mon Mar 31 19:39:50 GMT 2025`
Record UNII	K033C6226I
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

6-CHLORO-3-HYDROXY-4-METHYLTHIONAPHTHENE

Preferred Name

English

6-CHLORO-4-METHYLBENZO(B)THIOPHEN-3(2H)-ONE

Systematic Name

English

BENZO(B)THIOPHEN-3(2H)-ONE, 6-CHLORO-4-METHYL-

Systematic Name

English

6-CHLORO-4-METHYLTHIONAPHTHEN-3-ONE

Common Name

English

6-CHLORO-4-METHYL-3-(2H)THIANAPHTHENONE

Common Name

English

Code System Code Type Description

CAS

5858-07-1

Created by admin on Mon Mar 31 19:39:50 GMT 2025 , Edited by admin on Mon Mar 31 19:39:50 GMT 2025

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ECHA (EC/EINECS)

227-483-2

Created by admin on Mon Mar 31 19:39:50 GMT 2025 , Edited by admin on Mon Mar 31 19:39:50 GMT 2025

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EPA CompTox

DTXSID1064033

Created by admin on Mon Mar 31 19:39:50 GMT 2025 , Edited by admin on Mon Mar 31 19:39:50 GMT 2025

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FDA UNII

K033C6226I

Created by admin on Mon Mar 31 19:39:50 GMT 2025 , Edited by admin on Mon Mar 31 19:39:50 GMT 2025

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PUBCHEM

79962

Created by admin on Mon Mar 31 19:39:50 GMT 2025 , Edited by admin on Mon Mar 31 19:39:50 GMT 2025

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