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Details

Stereochemistry ACHIRAL
Molecular Formula C7H5NOS
Molecular Weight 151.186
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of BENZOXAZOLE-2-THIONE

SMILES

S=C1NC2=C(O1)C=CC=C2

InChI

InChIKey=FLFWJIBUZQARMD-UHFFFAOYSA-N
InChI=1S/C7H5NOS/c10-7-8-5-3-1-2-4-6(5)9-7/h1-4H,(H,8,10)

HIDE SMILES / InChI

Molecular Formula C7H5NOS
Molecular Weight 151.186
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

PubMed

PubMed

TitleDatePubMed
Dicarbonyl-chlorido(phen-oxy-thio-carbonyl-κC,S)bis-(triphenyl-phosphane-κP)molybdenum(II).
2010-12-24
Removal of 2-mercaptobenzoxazole from water as model of odorous mercaptan compounds by a heterogenous photocatalytic process using Ag-ZnO nanocomposite coated thin film on glass plate.
2010-12
Detection of lung, breast, colorectal, and prostate cancers from exhaled breath using a single array of nanosensors.
2010-08-10
Experimental and theoretical study of the structures and enthalpies of formation of 3H-1,3-benzoxazole-2-thione, 3H-1,3-benzothiazole-2-thione, and their tautomers.
2010-06-03
Molecular structure, IR spectra of 2-mercaptobenzothiazole and 2-mercaptobenzoxazole by density functional theory and ab initio Hartree-Fock calculations.
2009-09-15
2-(1,3-Benzoxazol-2-ylsulfan-yl)-1-phenyl-ethanone.
2009-08-29
Synthesis, characterization, and biological studies of organotin(IV) derivatives with o- or p-hydroxybenzoic acids.
2009
Simultaneous square wave voltammetric determination of 2-mercaptobenzothiazole and 2-mercaptobenzoxazole by partial least squares method in water samples.
2008-03-01
Biological studies of new organotin(IV) complexes of thioamide ligands.
2008-02
Crystal structure and antitumor activity of the novel zwitterionic complex of tri-n-butyltin(IV) with 2-thiobarbituric acid.
2008
Comparison of the adsorption orientation for 2-mercaptobenzothiazole and 2-mercaptobenzoxazole by SERS spectroscopy.
2007-12-31
Highly selective and sensitive spectrophotometric determination of trace amounts of silver ion in surfactant media using 2-mercaptobenzoxazole.
2007-09
Synthesis, structural characterization, and biological studies of six- and five-coordinate organotin(IV) complexes with the thioamides 2-mercaptobenzothiazole, 5-chloro-2-mercaptobenzothiazole, and 2-mercaptobenzoxazole.
2007-02-19
Respective contributions of polar vs enthalpy effects in the addition/fragmentation of mercaptobenzoxazole-derived thiyl radicals and analogues to double bonds.
2006-10-19
Surface-enhanced Raman scattering investigation of the adsorption of 2-mercaptobenzoxazole on smooth copper surfaces doped with silver colloidal nanoparticles.
2006-05-11
Solid-phase synthesis of the 2-aminobenzoxazole library using thioether linkage as the safety-catch linker.
2006-05-09
Domino Michael addition-carbene rearrangement-cyclization reaction of 1-alkynyl(aryl)-lambda3-bromanes with 2-mercapto-1,3-benzazoles.
2005-10-28
Electroorganic synthesis of catecholthioethers.
2005-09-16
Synthesis and biological evaluation with plant cells of new fosmidomycin analogues containing a benzoxazolone or oxazolopyridinone ring.
2004-12
Heterocyclic benzazole derivatives with antimycobacterial in vitro activity.
2002-11-18
Biomimetic studies on iodothyronine deiodinase intermediates: modeling the reduction of selenenyl iodide by thiols.
2002-05-03
Patents
Substance Class Chemical
Created
by admin
on Mon Mar 31 17:53:41 GMT 2025
Edited
by admin
on Mon Mar 31 17:53:41 GMT 2025
Record UNII
7PFU48RAFX
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
BENZOXAZOLE-2-THIONE
Systematic Name English
NSC-209084
Preferred Name English
2-MERCAPTOBENZOXAZOLE
Systematic Name English
2-BENZOXAZOLETHIOL
Systematic Name English
NSC-2128
Code English
Code System Code Type Description
FDA UNII
7PFU48RAFX
Created by admin on Mon Mar 31 17:53:41 GMT 2025 , Edited by admin on Mon Mar 31 17:53:41 GMT 2025
PRIMARY
NSC
2128
Created by admin on Mon Mar 31 17:53:41 GMT 2025 , Edited by admin on Mon Mar 31 17:53:41 GMT 2025
PRIMARY
NSC
209084
Created by admin on Mon Mar 31 17:53:41 GMT 2025 , Edited by admin on Mon Mar 31 17:53:41 GMT 2025
PRIMARY
MESH
C525534
Created by admin on Mon Mar 31 17:53:41 GMT 2025 , Edited by admin on Mon Mar 31 17:53:41 GMT 2025
PRIMARY
EPA CompTox
DTXSID8062363
Created by admin on Mon Mar 31 17:53:41 GMT 2025 , Edited by admin on Mon Mar 31 17:53:41 GMT 2025
PRIMARY
CAS
2382-96-9
Created by admin on Mon Mar 31 17:53:41 GMT 2025 , Edited by admin on Mon Mar 31 17:53:41 GMT 2025
PRIMARY
ECHA (EC/EINECS)
219-191-9
Created by admin on Mon Mar 31 17:53:41 GMT 2025 , Edited by admin on Mon Mar 31 17:53:41 GMT 2025
PRIMARY
PUBCHEM
712377
Created by admin on Mon Mar 31 17:53:41 GMT 2025 , Edited by admin on Mon Mar 31 17:53:41 GMT 2025
PRIMARY