2-(2-THIENYLMETHYL)-3-THIOPHENECARBOXYLIC ACID

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C10H8O2S2
Molecular Weight	224.299
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 2-(2-THIENYLMETHYL)-3-THIOPHENECARBOXYLIC ACID

Structure Search

SMILES

OC(=O)C1=C(CC2=CC=CS2)SC=C1

InChI

InChIKey=QPKATRSLASRXRU-UHFFFAOYSA-N

InChI=1S/C10H8O2S2/c11-10(12)8-3-5-14-9(8)6-7-2-1-4-13-7/h1-5H,6H2,(H,11,12)

HIDE SMILES / InChI

Molecular Formula	C10H8O2S2
Molecular Weight	224.299
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 `Tue Apr 01 19:53:01 GMT 2025` Edited by `admin` on `Tue Apr 01 19:53:01 GMT 2025`
Record UNII	4J629U26DJ
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

NSC-149700

Preferred Name

English

2-(2-THIENYLMETHYL)-3-THIOPHENECARBOXYLIC ACID

Systematic Name

English

3-THIOPHENECARBOXYLIC ACID, 2-(2-THIENYLMETHYL)-

Systematic Name

English

Code System Code Type Description

NSC

149700

Created by admin on Tue Apr 01 19:53:01 GMT 2025 , Edited by admin on Tue Apr 01 19:53:01 GMT 2025

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FDA UNII

4J629U26DJ

Created by admin on Tue Apr 01 19:53:01 GMT 2025 , Edited by admin on Tue Apr 01 19:53:01 GMT 2025

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EPA CompTox

DTXSID10185771

Created by admin on Tue Apr 01 19:53:01 GMT 2025 , Edited by admin on Tue Apr 01 19:53:01 GMT 2025

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CAS

31936-90-0

Created by admin on Tue Apr 01 19:53:01 GMT 2025 , Edited by admin on Tue Apr 01 19:53:01 GMT 2025

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PUBCHEM

288488

Created by admin on Tue Apr 01 19:53:01 GMT 2025 , Edited by admin on Tue Apr 01 19:53:01 GMT 2025

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