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Details

Stereochemistry ACHIRAL
Molecular Formula C2H2N3.Na
Molecular Weight 91.0471
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of SODIUM 1H-1,2,4-TRIAZOLATE

SMILES

[Na+].[N-]1C=NC=N1

InChI

InChIKey=NVMNEWNGLGACBB-UHFFFAOYSA-N
InChI=1S/C2H2N3.Na/c1-3-2-5-4-1;/h1-2H;/q-1;+1

HIDE SMILES / InChI
Molecular Formula C2H3N3
Molecular Weight 69.0653
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE
Molecular Formula Na
Molecular Weight 22.9898
Charge 1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Unknown
139594
PubMed

PubMed

TitleDatePubMed
[Synthesis and antibacterial activities of 3,6-disubstituted-5,6-dihydrogen-1,2,4-s-triazolo-[3,4-b]-1,3,4-thiadiazoles].
2001 Apr
[Enantiomeric separations of 1-1,2,4-triazole compounds by micro-high performance liquid chromatography].
2001 May
Effects of sensitizers on the photodegradation of the systemic fungicide triadimenol.
2003 Apr
Synthesis and properties of new substituted 1,2,4-triazoles: potential antitumor agents.
2003 Apr 17
Different oxidation states of copper(I, I/II, II) thiocyanate complexes containing 1,2,4-triazole as a bridging ligand: syntheses, crystal structures, and magnetic properties of 2-D polymer Cu I(admtrz)SCN, linear trinuclear [CuI2CuII(admtrz)6(SCN)2](ClO4)2, and triangular trinuclear [CuII3(admtrz)4(SCN)3(mu3-OH)(H2O)](ClO4)2.H2O (admtrz = 4-amino-3,5-dimethyl-1,2,4-triazole).
2003 Jan 13
[Room-temperature solid-state synthesis of complexes of copper acetate and multi-nitrogen heterocyclic ligands].
2003 Jun
Design and synthesis of 4H-3-(2-phenoxy)phenyl-1,2,4-triazole derivatives as benzodiazepine receptor agonists.
2003 Mar 6
Synthesis of some functionalized arylaminomethyl-1 ,2,4-triazoles, 1,3,4-oxa- and thiadiazoles.
2003 Nov
Solution and solid-supported synthesis of 3,4,5-trisubstituted 1,2,4-triazole-based peptidomimetics.
2003 Nov 13
Synthesis, X-ray diffraction structures, spectroscopic properties, and in vitro antitumor activity of isomeric (1H-1,2,4-triazole)Ru(III) complexes.
2003 Sep 22
The susceptibility of certain microbial strains to fused 1,2,4-triazole derivatives.
2004
Synthesis and antimycobacterial activity of 1,2,4-triazole 3-benzylsulfanyl derivatives.
2004 Apr
Synthesis of 5-(2-,3- and 4-methoxyphenyl)-4H-1,2,4-triazole-3-thiol derivatives exhibiting anti-inflammatory activity.
2004 Apr
Simultaneous determination of cefatrizine and clavulanic acid in dog plasma by HPLC.
2004 Apr 1
Efficient and regiospecific one-pot synthesis of substituted 1,2,4-triazoles.
2004 Aug 19
New substituted piperazines as ligands for melanocortin receptors. Correlation to the X-ray structure of "THIQ".
2004 Aug 26
Synthesis and anticonvulsant activity of new 2-substituted-5- [2-(2-fluorophenoxy)phenyl]-1,3,4-oxadiazoles and 1,2,4-triazoles.
2004 Dec 20
Synthesis and SAR evaluation of 1,2,4-triazoles as A(2A) receptor antagonists.
2004 Feb 9
Discovery of 5-(4-chlorophenyl)-1-(2,4-dichlorophenyl)-3-hexyl-1h-1,2,4-triazole, a novel in vivo cannabinoid antagonist containing a 1,2,4-triazole motif.
2004 May 20
Tuning of redox potentials for the design of ruthenium anticancer drugs -- an electrochemical study of [trans-RuCl(4)L(DMSO)](-) and [trans-RuCl(4)L(2)](-) complexes, where L = imidazole, 1,2,4-triazole, indazole.
2004 Nov 1
Enzymatic resolution for the preparation of enantiomerically enriched D-beta-heterocyclic alanine derivatives using Escherichia coli aromatic L-amino acid transaminase.
2004 Nov 20
Kinetic and mechanistic study on the reaction of alkylcobaloximes with azoles.
2004 Nov 21
Highly efficient and mild copper-catalyzed N- and C-arylations with aryl bromides and iodides.
2004 Nov 5
Synthesis and antimycobacterial activity of pyridylmethylsulfanyl and naphthylmethylsulfanyl derivatives of benzazoles, 1, 2, 4-triazole, and pyridine-2-carbothioamide/-2-carbonitrile.
2004 Oct
Synthesis, antitumor and antiviral properties of some 1,2,4-triazole derivatives.
2004 Oct
Synthesis and antimicrobial activities of some new 1-(5-phenylamino-[1,3,4]thiadiazol-2-yl)methyl-5-oxo-[1,2,4]triazole and 1-(4-phenyl-5-thioxo-[1,2,4]triazol-3-yl)methyl-5-oxo- [1,2,4]triazole derivatives.
2004 Sep
Mechanistic elucidation of the substitution behavior of alkyl cobaloximes in water and methanol as solvents.
2004 Sep 20
Double-headed acyclo C-nucleoside analogues. Functionalized 1,2-bis-(1,2,4-triazol-3-yl)ethane-1,2-diol.
2005
Microwave irradiation for accelerating the synthesis of acyclonucleosides of 1,2,4-triazole.
2005
Catalase inhibition by amino triazole induces oxidative stress in goldfish brain.
2005 Aug 9
Synthesis and structure-activity relationships of 1,2,4-triazoles as a novel class of potent tubulin polymerization inhibitors.
2005 Dec 1
Energetic azolium azolate salts.
2005 Jul 11
Adaptive response of antioxidant enzymes to catalase inhibition by aminotriazole in goldfish liver and kidney.
2005 Nov
Synthesis and some first-row transition-metal complexes of the 1,2,4-triazole-based Bis(terdentate) ligands TsPMAT and PMAT.
2005 Nov 18
Metal ion coordination to azole nucleosides.
2005 Oct 21
Syntheses, structures, and magnetic properties of unusual nonlinear polynuclear copper(II) complexes containing derivatives of 1,2,4-triazole and pivalate ligands.
2005 Oct 31
Tuning of redox properties for the design of ruthenium anticancer drugs: part 2. Syntheses, crystal structures, and electrochemistry of potentially antitumor [Ru III/II Cl6-n(Azole)n]z(n = 3, 4, 6) complexes.
2005 Sep 19
Determination of 22 triazole compounds including parent fungicides and metabolites in apples, peaches, flour, and water by liquid chromatography/tandem mass spectrometry.
2005 Sep-Oct
Electronic properties, redox behavior, and interactions with H2O2 of pH-sensitive hydroxyphenyl-1,2,4-triazole-based oxovanadium(V) complexes.
2006 Apr 3
Quantum chemical study of the structure and thermochemistry of the five-membered nitrogen-containing heterocycles and their anions and radicals.
2006 Dec 28
Synthesis of cyclopentenyl carbocyclic nucleosides as potential antiviral agents against orthopoxviruses and SARS.
2006 Feb 9
Synthesis and CYP26A1 inhibitory activity of 1-[benzofuran-2-yl-(4-alkyl/aryl-phenyl)-methyl]-1H-triazoles.
2006 Jun 1
Photoresponsive molecular wires of FeII triazole complexes in organic media and light-induced morphological transformations.
2006 Jun 21
Microwave-assisted organic synthesis of 3-(D-Gluco-pentitol-1-yl)-1H-1,2,4-triazole.
2006 Mar
Photodegradation kinetics of some thiols and thiones in aqueous suspension of zinc oxide.
2006 May-Jun
Solid-state coordination chemistry of the Cu/triazolate/X system (X = F-, Cl-, Br-, I-, OH-, and SO4(2-)).
2006 Nov 13
Experimental and theoretical study of the coordination of 1,2,4-triazolato, tetrazolato, and pentazolato ligands to the [K(18-crown-6)]+ fragment.
2006 Oct 16
Molecular simulation study of some thermophysical and transport properties of triazolium-based ionic liquids.
2006 Sep 14
Synthesis of 1,2,4-triazole C-nucleosides from hydrazonyl chlorides and nitriles.
2007
3D-QSAR study of sulfonamide inhibitors of human carbonic anhydrase II.
2007 Mar
Patents

Patents

04079143
2
04087533
2
04229459
2
04232034
2
04239525
2
04269845
2
04366165
2
04382944
2
04387100
3
04400509
5
04610981
3
04661507
2
04797499
2
04822902
3
04833159
2
04870092
2
04886892
2
04888048
2
04929735
2
04963575
2
04980488
2
05057531
2
05082855
2
05091539
3
05227393
2
05334608
2
05426196
2
05473078
2
05489591
2
05514717
3
05554620
6
05604240
2
05605921
2
05629346
2
05656642
2
05670453
5
05707976
4
05750719
2
05767263
2
05783572
2
05807880
2
05879938
2
05977075
2
05977152
3
06083968
2
06172266
2
06300353
7
06319939
2
06376672
2
06576762
3
06586617
6
06949579
3
Substance Class Chemical
Created
by admin
on Sat Dec 16 07:56:44 GMT 2023
Edited
by admin
on Sat Dec 16 07:56:44 GMT 2023
Record UNII
X90002Y44E
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
SODIUM 1H-1,2,4-TRIAZOLATE
Systematic Name English
SODIUM 1H-1,2,4-TRIAZOLIDE
Systematic Name English
1H-1,2,4-TRIAZOLE, SODIUM SALT
Systematic Name English
1H-1,2,4-TRIAZOLE, SODIUM SALT (1:1)
Systematic Name English
J321.870H
Code English
1,2,4-TRIAZOLE, SODIUM SALT
Common Name English
Code System Code Type Description
ECHA (EC/EINECS)
255-280-9
Created by admin on Sat Dec 16 07:56:44 GMT 2023 , Edited by admin on Sat Dec 16 07:56:44 GMT 2023
PRIMARY
PUBCHEM
4649906
Created by admin on Sat Dec 16 07:56:44 GMT 2023 , Edited by admin on Sat Dec 16 07:56:44 GMT 2023
PRIMARY
FDA UNII
X90002Y44E
Created by admin on Sat Dec 16 07:56:44 GMT 2023 , Edited by admin on Sat Dec 16 07:56:44 GMT 2023
PRIMARY
CAS
41253-21-8
Created by admin on Sat Dec 16 07:56:44 GMT 2023 , Edited by admin on Sat Dec 16 07:56:44 GMT 2023
PRIMARY
EPA CompTox
DTXSID6032722
Created by admin on Sat Dec 16 07:56:44 GMT 2023 , Edited by admin on Sat Dec 16 07:56:44 GMT 2023
PRIMARY
Related Record Type Details
Structure of 1H-1,2,4-TRIAZOLE
PARENT -> SALT/SOLVATE
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