2-THIOPHENECARBOXYLIC ACID

Details

Stereochemistry	ACHIRAL
Molecular Formula	C5H4O2S
Molecular Weight	128.149
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

OC(=O)C1=CC=CS1

InChI

InChIKey=QERYCTSHXKAMIS-UHFFFAOYSA-N

InChI=1S/C5H4O2S/c6-5(7)4-2-1-3-8-4/h1-3H,(H,6,7)

HIDE SMILES / InChI

Molecular Formula	C5H4O2S
Molecular Weight	128.149
Charge	0
Count

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

Approval Year

PubMed

Title	Date	PubMed
Synthesis, structure and biological activity of nickel(II) complexes of 5-methyl 2-furfural thiosemicarbazone.	2001 Sep	11566328
Platinum(II) complexes with 2-acetyl pyridine thiosemicarbazone. Synthesis, crystal structure, spectral properties, antimicrobial and antitumour activity.	2001 Sep	11566327
Kinetics and mechanism of oxygen atom abstraction from a dioxo-rhenium(VII) complex.	2002 Sep 9	12206697
The first triple thiol-thiolate hydrogen bond versus triple diselenide bond that bridges two metal centers.	2003 Aug 6	12889924
Structure and reactivity of a chromium(v) glutathione complex.	2003 Feb 10	12562191
Transition metal complexes of phenanthrenequinone thiosemicarbazone as potential anticancer agents: synthesis, structure, spectroscopy, electrochemistry and in vitro anticancer activity against human breast cancer cell-line, T47D.	2003 Jul 1	12818801
Mycobacterium celatum pulmonary infection in the immunocompetent: case report and review.	2003 Mar	12643843
Competition between glutathione and guanine for a ruthenium(II) arene anticancer complex: detection of a sulfenato intermediate.	2005 Dec 21	16351102
Prediction of genotoxicity of chemical compounds by statistical learning methods.	2005 Jun	15962942
Synthesis of allenamides by copper-catalyzed coupling of allenyl halides with amides, carbamates, and ureas.	2005 May 26	15901148
Total synthesis, structure revision, and absolute configuration of (-)-brevenal.	2006 Dec 27	17177450
Photooxidation of Co-thiolato complexes in protic and aprotic solvents.	2006 Mar 7	16491188
Rapid freeze-quench ENDOR study of chloroperoxidase compound I: the site of the radical.	2006 May 3	16637602
Ambient temperature synthesis of high enantiopurity N-protected peptidyl ketones by peptidyl thiol ester-boronic acid cross-coupling.	2007 Feb 7	17263394
Stereospecific cross-coupling of alpha-(thiocarbamoyl)organostannanes with alkenyl, aryl, and heteroaryl iodides.	2007 Jan 31	17243814
Stable diplatinum complexes with functional thiolato bridges from dialkylation of [Pt2(mu-S)2(P-P)2] [P-P=2 x PPh3, Ph2P(CH2)3PPh2].	2007 Sep 28	17828361
Bis(4,6-diamino-pyrimidin-2-yl) disulfide dimethyl sufoxide disolvate.	2008 Aug 9	21201707
Mycobacterium bovis strains causing smear-positive human tuberculosis, Southwest Ireland.	2008 Dec	19046525
Genomic interrogation of ancestral Mycobacterium tuberculosis from south India.	2008 Jul	18024233
Design, syntheses, and characterization of dioxo-molybdenum(VI) complexes with thiolate ligands: effects of intraligand NH...S hydrogen bonding.	2008 May 21	18443699
Di-platinum complexes containing thiolato-urea ligands: structural and anion binding studies.	2009 Apr 28	19352525
Synthesis and reactions of mono- and dinuclear Ni(I) thiolate complexes.	2009 Mar 2	19235981
Copper-catalyzed N-allenylation of allylic sulfonamides.	2009 Sep 3	19670851
Chlorido[1-(4,5-dihydro-1,3-thia-zol-2-yl-κN)ethanone thio-semicarbazonato-κN,S]nickel(II).	2010 Dec 15	21522596
Differential reactivity of thiophene-2-carboxylic and thiophene-3-carboxylic acids: Results from DFT and Hartree-Fock theory.	2010 Feb 26	20060346
Evaluation of a Rapid Differentiation Test for Mycobacterium Tuberculosis from other Mycobacteria by Selective Inhibition with p-nitrobenzoic Acid using MGIT 960.	2010 Jul	21346904
Protective efficacy of BCG overexpressing an L,D-transpeptidase against M. tuberculosis infection.	2010 Oct 29	21048936
Iron(II)-thiolate S-oxygenation by O2: synthetic models of cysteine dioxygenase.	2010 Sep 8	20712312

Patents

Substance Class	Chemical Created by `admin` on `Fri Dec 15 15:14:49 GMT 2023` Edited by `admin` on `Fri Dec 15 15:14:49 GMT 2023`
Record UNII	3FD00JX53J
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

2-THIOPHENECARBOXYLIC ACID

Systematic Name

English

2-THENOIC ACID

Systematic Name

English

2-THIOPHENECARBOXYLIC ACID [MI]

Common Name

English

2-CARBOXYTHIOPHENE

Systematic Name

English

Thenoic acid [WHO-DD]

Common Name

English

NSC-2188

Code

English

2-THIENYLCARBOXYLIC ACID

Systematic Name

English

2-THIOPHENIC ACID

Systematic Name

English

THENOIC ACID

Systematic Name

English

TENOIC ACID

Common Name

English

Code System Code Type Description

EPA CompTox

DTXSID2060177