2-ACETYL-5-METHYLTHIOPHENE

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National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C7H8OS
Molecular Weight	140.203
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 2-ACETYL-5-METHYLTHIOPHENE

Structure Search

SMILES

CC(=O)C1=CC=C(C)S1

InChI

InChIKey=YOSDTJYMDAEEAZ-UHFFFAOYSA-N

InChI=1S/C7H8OS/c1-5-3-4-7(9-5)6(2)8/h3-4H,1-2H3

HIDE SMILES / InChI

Molecular Formula	C7H8OS
Molecular Weight	140.203
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

PubMed

PubMed

Title	Date	PubMed
Investigation of trypanothione reductase as a drug target in Trypanosoma brucei.	2009 Dec	19924760

Substance Class	Chemical Created by `admin` on `Sat Dec 16 01:22:21 GMT 2023` Edited by `admin` on `Sat Dec 16 01:22:21 GMT 2023`
Record UNII	2HS3I278W9
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

2-ACETYL-5-METHYLTHIOPHENE

Systematic Name

English

KETONE, METHYL 5-METHYL-2-THIENYL

Systematic Name

English

METHYL 5-METHYL-2-THIENYL KETONE

Systematic Name

English

ETHANONE, 1-(5-METHYL-2-THIENYL)-

Systematic Name

English

FEMA NO. 4643

Code

English

2-METHYL-5-ACETYLTHIOPHENE

Systematic Name

English

1-(5-METHYL-2-THIENYL)ETHANONE

Systematic Name

English

5-METHYL-2-THIENYL METHYL KETONE

Systematic Name

English

Classification Tree Code System Code

JECFA EVALUATION

2-ACETYL-5-METHYLTHIOPHENE

Created by admin on Sat Dec 16 01:22:21 GMT 2023 , Edited by admin on Sat Dec 16 01:22:21 GMT 2023

Code System Code Type Description

FDA UNII

2HS3I278W9

Created by admin on Sat Dec 16 01:22:21 GMT 2023 , Edited by admin on Sat Dec 16 01:22:21 GMT 2023

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EPA CompTox

DTXSID10159932

Created by admin on Sat Dec 16 01:22:21 GMT 2023 , Edited by admin on Sat Dec 16 01:22:21 GMT 2023

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PUBCHEM

83655

Created by admin on Sat Dec 16 01:22:21 GMT 2023 , Edited by admin on Sat Dec 16 01:22:21 GMT 2023

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JECFA MONOGRAPH

2084

Created by admin on Sat Dec 16 01:22:21 GMT 2023 , Edited by admin on Sat Dec 16 01:22:21 GMT 2023

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CAS

13679-74-8

Created by admin on Sat Dec 16 01:22:21 GMT 2023 , Edited by admin on Sat Dec 16 01:22:21 GMT 2023

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ECHA (EC/EINECS)

237-181-2

Created by admin on Sat Dec 16 01:22:21 GMT 2023 , Edited by admin on Sat Dec 16 01:22:21 GMT 2023

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