Computational studies on the regioselectivity of metal-catalyzed synthesis of 1,2,3 triazoles via click reaction: a review

In situ prepared copper nanoparticles on modified KIT-5 as an efficient recyclable catalyst and its applications in click reactions in water

(2015) Razieh Mirsafaei et al.   JOURNAL OF MOLECULAR CATALYSIS A-CHEMICAL

Iridium-Catalyzed Intermolecular Azide-Alkyne Cycloaddition of Internal Thioalkynes under Mild Conditions

(2014) Shengtao Ding et al.   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

Recent Applications of Click Reaction in the Syntheses of 1,2,3-triazoles

(2014) Majid Heravi et al.   CURRENT ORGANIC SYNTHESIS

PdCl 2 on modified poly(styrene-co-maleic anhydride): A highly active and recyclable catalyst for the Suzuki–Miyaura and Sonogashira reactions

(2014) Majid M. Heravi et al.   JOURNAL OF MOLECULAR CATALYSIS A-CHEMICAL

Theoretical Studies on the Regioselectivity of Iridium-Catalyzed 1,3-Dipolar Azide–Alkyne Cycloaddition Reactions

(2014) Qiong Luo et al.   JOURNAL OF ORGANIC CHEMISTRY

Negishi coupling: an easy progress for C–C bond construction in total synthesis

(2014) Majid M. Heravi et al.   MOLECULAR DIVERSITY

Regioselectivity of Vinyl Sulfone Based 1,3-Dipolar Cycloaddition Reactions with Sugar Azides by Computational and Experimental Studies

(2014) Debashis Sahu et al.   ORGANIC LETTERS

Recent advances in the application of the Oppolzer camphorsultam as a chiral auxiliary

(2014) Majid M. Heravi et al.   TETRAHEDRON-ASYMMETRY

In situ prepared CuI nanoparticles on modified poly(styrene-co-maleic anhydride): an efficient and recyclable catalyst for the azide–alkyne click reaction in water

(2014) Elaheh Hashemi et al.   TRANSITION METAL CHEMISTRY

A general route to 1,5-disubstituted 1,2,3-triazoles with alkyl/alkyl, alkyl/aryl, aryl/aryl combinations: a metal-free, regioselective, one-pot three component approach

(2014) Santu Dey et al.   RSC Advances

Study of electronic properties, stabilities and magnetic quenching of molybdenum-doped germanium clusters: a density functional investigation

(2014) Ravi Trivedi et al.   RSC Advances

1,5-Disubstituted 1,2,3-Triazolylation at C1, C2, C3, C4, and C6 of Pyranosides: A Metal-Free Route to Triazolylated Monosaccharides and Triazole-Linked Disaccharides

(2013) Anirban Kayet et al.   JOURNAL OF ORGANIC CHEMISTRY

Green and Facile Synthesis of 1,4-Disubstituted 1,2,3-Triazoles via a Click Reaction of α-Bromo Ketones, [bmim]N3 and Terminal Acetylenes

(2013) Azadeh Fazeli et al.   LETTERS IN ORGANIC CHEMISTRY

Recent advances in C-heteroatom bond forming by asymmetric Michael addition

(2013) Majid M. Heravi et al.   MOLECULAR DIVERSITY

Iridium-Catalyzed Cycloaddition of Azides and 1-Bromoalkynes at Room Temperature

(2013) Evelia Rasolofonjatovo et al.   ORGANIC LETTERS

Recent developments of the Stille reaction as a revolutionized method in total synthesis

(2013) Majid M. Heravi et al.   TETRAHEDRON

Recent advances in the Cu(i)-catalyzed azide–alkyne cycloaddition: focus on functionally substituted azides and alkynes

(2013) Nadezhda V. Sokolova et al.   RSC Advances

Discovery of a Robust and Efficient Homogeneous Silver(I) Catalyst for the Cycloaddition of Azides onto Terminal Alkynes

(2012) James McNulty et al.   EUROPEAN JOURNAL OF ORGANIC CHEMISTRY

Architectures, electronic structures, and stabilities of Cu-doped Ge n clusters: density functional modeling

(2012) Debashis Bandyopadhyay   JOURNAL OF MOLECULAR MODELING

Regioselectivity in Sonogashira synthesis of 6-(4-nitrobenzyl)-2-phenylthiazolo[3,2-b]1,2,4-triazole: a quantum chemistry study

(2012) Tayebeh Hosseinnejad et al.   JOURNAL OF MOLECULAR MODELING

Reaction mechanism of ruthenium-catalyzed azide–alkyne cycloaddition reaction: A DFT study

(2012) Esra Boz et al.   JOURNAL OF ORGANOMETALLIC CHEMISTRY

Recent advances in application of intramolecular Suzuki cross-coupling in cyclization and heterocyclization

(2012) Majid M. Heravi et al.   MONATSHEFTE FUR CHEMIE

Recent advances in Kumada-Tamao-Corriu cross-coupling reaction catalyzed by different ligands

(2012) Majid M. Heravi et al.   MONATSHEFTE FUR CHEMIE

Coordinatively Unsaturated Ruthenium Complexes As Efficient Alkyne–Azide Cycloaddition Catalysts

(2012) Marina Lamberti et al.   ORGANOMETALLICS

Click Synthesis of 5-Substituted 1H-Tetrazoles from Aldehydes, Hydroxyl­amine, and [bmim]N3 via One-Pot, Three-Component Reaction

(2012) Majid Heravi et al.   SYNLETT

Recent applications of the Suzuki reaction in total synthesis

(2012) Majid M. Heravi et al.   TETRAHEDRON

Recent applications of organocatalysts in asymmetric aldol reactions

(2012) Majid M. Heravi et al.   TETRAHEDRON-ASYMMETRY

Recent advances in steroidal supramolecular gels

(2012) Hana Svobodová et al.   RSC Advances

The First Well-Defined Silver(I)-Complex-Catalyzed Cycloaddition of Azides onto Terminal Alkynes at Room Temperature

(2011) James McNulty et al.   CHEMISTRY-A EUROPEAN JOURNAL

KAl(SO4)2·12H2O catalyzed efficient synthesis of 3,4,6-trisubstituted 2-pyridone in water

(2011) Majid M. Heravi et al.   CHINESE CHEMICAL LETTERS

1,2,3-Triazoles in Peptidomimetic Chemistry

(2011) Daniel Sejer Pedersen et al.   EUROPEAN JOURNAL OF ORGANIC CHEMISTRY

Selective Transition State Stabilization via Hyperconjugative and Conjugative Assistance: Stereoelectronic Concept for Copper-Free Click Chemistry

(2011) Brian Gold et al.   JOURNAL OF ORGANIC CHEMISTRY

Assessing the whole range of CuAAC mechanisms by DFT calculations—on the intermediacy of copper acetylides

(2011) David Cantillo et al.   ORGANIC & BIOMOLECULAR CHEMISTRY

Generation of Medium-Ring Cycloalkynes by Ring Expansion of Vinylogous Acyl Triflates

(2011) Jumreang Tummatorn et al.   ORGANIC LETTERS

Heterogeneous azide–alkyne click chemistry: towards metal-free end products

(2011) Bart Dervaux et al.   Chemical Science

Direct Synthesis of 1,4-Disubstituted-5-alumino-1,2,3-triazoles: Copper-Catalyzed Cycloaddition of Organic Azides and Mixed Aluminum Acetylides

(2010) Yuhan Zhou et al.   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

Synthesis and antimicrobial activity of 1,2,3-triazoles containing quinoline moiety

(2010) V. Sumangala et al.   ARCHIVES OF PHARMACAL RESEARCH

Expedient synthesis of coumarin-coupled triazoles via ‘click chemistry’ leading to the formation of coumarin–triazole–sugar hybrids

(2010) K. Karthik Kumar et al.   CARBOHYDRATE RESEARCH

Copper-catalyzed azide–alkyne cycloaddition (CuAAC) and beyond: new reactivity of copper(i) acetylides

(2010) Jason E. Hein et al.   CHEMICAL SOCIETY REVIEWS

Cu-free click cycloaddition reactions in chemical biology

(2010) John C. Jewett et al.   CHEMICAL SOCIETY REVIEWS

Experimental Evidence for the Involvement of Dinuclear Alkynylcopper(I) Complexes in Alkyne-Azide Chemistry

(2010) Benjamin R. Buckley et al.   CHEMISTRY-A EUROPEAN JOURNAL

Novel synthesis of 1,2,3-Triazoles via 1,3-dipolar cycloadditions of alkynes to azides in ionic liquid

(2010) Ping Zhong et al.   CHINESE JOURNAL OF CHEMISTRY

Synthesis and theoretical studies on energetics of novel N- and O- perfluoroalkyl triazole tagged thienopyrimidines – Their potential as adenosine receptor ligands

(2010) B. Sirisha et al.   EUROPEAN JOURNAL OF MEDICINAL CHEMISTRY

Synthesis and biological evaluation of new 2-chloro-3-((4-phenyl-1H-1,2,3-triazol-1-yl)methyl)quinoline derivatives via click chemistry approach

(2010) Amol H. Kategaonkar et al.   EUROPEAN JOURNAL OF MEDICINAL CHEMISTRY

Recent Advances in the Application of the Heck Reaction in the Synthesis of Heterocyclic Compounds

(2010) Majid M. Heravi et al.   HETEROCYCLES

Synthesis of DOTA-Conjugated Multimeric [Tyr3]Octreotide Peptides via a Combination of Cu(I)-Catalyzed “Click” Cycloaddition and Thio Acid/Sulfonyl Azide “Sulfo-Click” Amidation and Their in Vivo Evaluation

(2010) Cheng-Bin Yim et al.   JOURNAL OF MEDICINAL CHEMISTRY

Ring Opening of Cyclic Vinylogous Acyl Triflates Using Stabilized Carbanion Nucleophiles: Claisen Condensation Linked to Carbon−Carbon Bond Cleavage

(2010) David M. Jones et al.   JOURNAL OF ORGANIC CHEMISTRY

Density Functional Investigation of Structure and Stability of Genand GenNi (n= 1−20) Clusters: Validity of the Electron Counting Rule

(2010) Debashis Bandyopadhyay et al.   JOURNAL OF PHYSICAL CHEMISTRY A

Origins of the Selectivity for Borylation of Primary over Secondary C−H Bonds Catalyzed by Cp*-Rhodium Complexes

(2010) Carolyn S. Wei et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Mechanism and Stereoselectivity of the Stepwise 1,3-Dipolar Cycloadditions between a Thiocarbonyl Ylide and Electron-Deficient Dipolarophiles: A Computational Investigation

(2010) Yu Lan et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Stereodefined Homopropargyl Amines by Tandem Nucleophilic Addition/Fragmentation of Dihydropyridone Triflates

(2010) Jumreang Tummatorn et al.   ORGANIC LETTERS

Electronic effects of ruthenium-catalyzed [3+2]-cycloaddition of alkynes and azides

(2010) Duen-Ren Hou et al.   TETRAHEDRON

Towards the synthesis of coumarin derivatives as potential dual-action HIV-1 protease and reverse transcriptase inhibitors

(2010) Temitope O. Olomola et al.   TETRAHEDRON LETTERS

Entropy versus tether strain effects on rates of intramolecular 1,3-dipolar cycloadditions of N-alkenylnitrones

(2010) Elizabeth H. Krenske et al.   TETRAHEDRON LETTERS

Copper(I)-Catalyzed Cycloaddition of Organic Azides and 1-Iodoalkynes

(2009) Jason E. Hein et al.   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

Dynamics of 1,3-Dipolar Cycloaddition Reactions of Diazonium Betaines to Acetylene and Ethylene: Bending Vibrations Facilitate Reaction

(2009) Lai Xu et al.   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

Click Chemistry beyond Metal-Catalyzed Cycloaddition

(2009) C. Remzi Becer et al.   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

Synthesis of novel 3-(1-(1-substituted piperidin-4-yl)-1H-1,2,3-triazol-4-yl)-1,2,4-oxadiazol-5(4H)-one as antifungal agents

(2009) Jaiprakash N. Sangshetti et al.   BIOORGANIC & MEDICINAL CHEMISTRY LETTERS

One pot synthesis and SAR of some novel 3-substituted 5,6-diphenyl-1,2,4-triazines as antifungal agents

(2009) Jaiprakash N. Sangshetti et al.   BIOORGANIC & MEDICINAL CHEMISTRY LETTERS

Regioselectivity in Organic Synthesis: Preparation of the Bromohydrin of alpha-Methylstyrene

(2009) Brad Andersh et al.   JOURNAL OF CHEMICAL EDUCATION

Pd(0)/Cu(I)-Mediated Direct Arylation of 2′-Deoxyadenosines: Mechanistic Role of Cu(I) and Reactivity Comparisons with Related Purine Nucleosides

(2009) Thomas E. Storr et al.   JOURNAL OF ORGANIC CHEMISTRY

Transition State Distortion Energies Correlate with Activation Energies of 1,4-Dihydrogenations and Diels−Alder Cycloadditions of Aromatic Molecules

(2009) Amy E. Hayden et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Reactivity and Regioselectivity in 1,3-Dipolar Cycloadditions of Azides to Strained Alkynes and Alkenes: A Computational Study

(2009) Franziska Schoenebeck et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

A highly active and reusable copper(i)-tren catalyst for the “click” 1,3-dipolar cycloaddition of azides and alkynes

(2008) Nicolas Candelon et al.   CHEMICAL COMMUNICATIONS

Cu-Catalyzed Azide−Alkyne Cycloaddition

(2008) Morten Meldal et al.   CHEMICAL REVIEWS

Synthesis, HIV-RT inhibitory activity and SAR of 1-benzyl-1H-1,2,3-triazole derivatives of carbohydrates

(2008) Fernando de C. da Silva et al.   EUROPEAN JOURNAL OF MEDICINAL CHEMISTRY

A density functional theory–based study of the electronic structures and properties of cage like metal doped silicon clusters

(2008) Debashis Bandyopadhyay   JOURNAL OF APPLIED PHYSICS

Design, Synthesis, and Biological Characterization of a Caspase 3/7 Selective Isatin Labeled with 2-[18F]fluoroethylazide

(2008) Graham Smith et al.   JOURNAL OF MEDICINAL CHEMISTRY

Predictions of Substituent Effects in Thermal Azide 1,3-Dipolar Cycloadditions:  Implications for Dynamic Combinatorial (Reversible) and Click (Irreversible) Chemistry

(2008) Gavin O. Jones et al.   JOURNAL OF ORGANIC CHEMISTRY

Ring Opening/Fragmentation of Dihydropyrones for the Synthesis of Homopropargyl Alcohols

(2008) Jumreang Tummatorn et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Theory of 1,3-Dipolar Cycloadditions: Distortion/Interaction and Frontier Molecular Orbital Models

(2008) Daniel H. Ess et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Ruthenium-Catalyzed Azide−Alkyne Cycloaddition: Scope and Mechanism

(2008) Brant C. Boren et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Transition States of Strain-Promoted Metal-Free Click Chemistry:  1,3-Dipolar Cycloadditions of Phenyl Azide and Cyclooctynes

(2008) Daniel H. Ess et al.   ORGANIC LETTERS

Long-range corrected hybrid density functionals with damped atom–atom dispersion corrections

(2008) Jeng-Da Chai et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

The synthesis of coumarin-3-carboxylic acids and 3-acetyl-coumarin derivatives using heteropolyacids as heterogeneous and recyclable catalysts

(2007) Majid M. Heravi et al.   CATALYSIS COMMUNICATIONS

Click chemistry reactions in medicinal chemistry: Applications of the 1,3-dipolar cycloaddition between azides and alkynes

(2007) Gian Cesare Tron et al.   MEDICINAL RESEARCH REVIEWS