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Select item 110418451.

Design, synthesis, and bioevaluation of novel unsaturated cyanoacetamide derivatives: In vitro and in silico exploration

Kabir M. Uddin, Mehnaz Hossain Meem, Mokseda Akter, Shofiur Rahman, Mahmoud A. Al-Gawati, Nahed Alarifi, Hamad Albrithen, Abdullah Alodhayb, Raymond A. Poirier, Md. Mosharef H. Bhuiyan

MethodsX. 2024 Jun; 12: 102691. Published online 2024 Apr 9. doi: 10.1016/j.mex.2024.102691

PMCID:: PMC11041845

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Select item 37219802.

Cyanoacetamide MCR (III): Three-Component Gewald Reactions Revisited

Kan Wang, Dabin Kim, Alexander Dömling

J Comb Chem. Author manuscript; available in PMC 2013 Jul 24.

Published in final edited form as: J Comb Chem. 2010 Jan-Feb; 12(1): 111–118. doi: 10.1021/cc9001586

PMCID:: PMC3721980

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Select item 90712023.

Impact of an aryl bulky group on a one-pot reaction of aldehyde with malononitrile and N-substituted 2-cyanoacetamide

Ruturajsinh M. Vala, Divyang M. Patel, Mayank G. Sharma, Hitendra M. Patel

RSC Adv. 2019 Sep 9; 9(49): 28886–28893. Published online 2019 Sep 13. doi: 10.1039/c9ra05975j

PMCID:: PMC9071202

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Select item 60179344.

A Novel Synthesis of Highly Functionalized Pyridines by a One-Pot, Three-Component Tandem Reaction of Aldehydes, Malononitrile and N-Alkyl-2-cyanoacetamides under Microwave Irradiation

Ramadan Ahmed Mekheimer, Mariam Abdullah Al-Sheikh, Hanadi Yousef Medrasi, Najla Hosain Hassan Alsofyani

Molecules. 2018 Mar; 23(3): 619. Published online 2018 Mar 9. doi: 10.3390/molecules23030619

PMCID:: PMC6017934

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Select item 62632665.

Acylation of Heteroaromatic Amines: Facile and Efficient Synthesis of a New Class of 1,2,3-Triazolo[4,5-b]pyridine and Pyrazolo[4,3-b]pyridine Derivatives

Hamada Mohamed Ibrahim, Haider Behbehani, Saad Makhseed, Mohamed H. Elnagdi

Molecules. 2011 May; 16(5): 3723–3739. Published online 2011 May 4. doi: 10.3390/molecules16053723

PMCID:: PMC6263266

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Select item 93345996.

Synthesis of innovative triphenylamine-functionalized organic photosensitizers outperformed the benchmark dye N719 for high-efficiency dye-sensitized solar cells

Safa A. Badawy, Ehab Abdel-Latif, Ahmed A. Fadda, Mohamed R. Elmorsy

Sci Rep. 2022; 12: 12885. Published online 2022 Jul 28. doi: 10.1038/s41598-022-17041-1

PMCID:: PMC9334599

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Select item 71167557.

Formation of interstellar cyanoacetamide: a rotational and computational study

M. Sanz-Novo, I. León, J. L. Alonso, A. Largo, C. Barrientos

Astron Astrophys. Author manuscript; available in PMC 2021 Feb 15.

Published in final edited form as: Astron Astrophys. 2020 Dec; 644: A3. Published online 2020 Nov 24. doi: 10.1051/0004-6361/202038766

PMCID:: PMC7116755

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Select item 99355388.

Anticancer evaluation and molecular docking of new pyridopyrazolo-triazine and pyridopyrazolo-triazole derivatives

Mohamed R. Elmorsy, Ehab Abdel-Latif, Hatem E. Gaffer, Samar E. Mahmoud, Ahmed A. Fadda

Sci Rep. 2023; 13: 2782. Published online 2023 Feb 16. doi: 10.1038/s41598-023-29908-y

PMCID:: PMC9935538

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Select item 79150269.

Sulfaguanidine Hybrid with Some New Pyridine-2-One Derivatives: Design, Synthesis, and Antimicrobial Activity against Multidrug-Resistant Bacteria as Dual DNA Gyrase and DHFR Inhibitors

Ahmed Ragab, Sawsan A. Fouad, Ola A. Abu Ali, Entsar M. Ahmed, Abeer M. Ali, Ahmed A. Askar, Yousry A. Ammar

Antibiotics (Basel) 2021 Feb; 10(2): 162. Published online 2021 Feb 5. doi: 10.3390/antibiotics10020162

PMCID:: PMC7915026

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Select item 663851610.

A phage display‐selected peptide inhibitor of Agrobacterium vitis polygalacturonase

Jeremy G. Warren, George W. Kasun, Takara Leonard, Bruce C. Kirkpatrick

Mol Plant Pathol. 2016 May; 17(4): 480–486. Published online 2015 Sep 18. doi: 10.1111/mpp.12293

PMCID:: PMC6638516

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Select item 1079502311.

Structural Optimization and Biological Evaluation of Isoxazolo[5,4-d]pyrimidines as Selective Toll-Like Receptor 7 Agonists

Nika Strašek Benedik, Ana Dolšak, Urban Švajger, Izidor Sosič, Stanislav Gobec, Matej Sova

ACS Omega. 2024 Jan 16; 9(2): 2362–2382. Published online 2024 Jan 4. doi: 10.1021/acsomega.3c06343

PMCID:: PMC10795023

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Select item 464667812.

Insights into the Activity and Substrate Binding of Xylella fastidiosa Polygalacturonase by Modification of a Unique QMK Amino Acid Motif Using Protein Chimeras

Jeremy G. Warren, James E. Lincoln, Bruce C. Kirkpatrick

PLoS One. 2015; 10(11): e0142694. Published online 2015 Nov 16. doi: 10.1371/journal.pone.0142694

PMCID:: PMC4646678

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Select item 810487913.

A diverse member of the fungal Avr4 effector family interacts with de-esterified pectin in plant cell walls to disrupt their integrity

Li-Hung Chen, Stjepan K. Kračun, Karen S. Nissen, Jozef Mravec, Bodil Jørgensen, John Labavitch, Ioannis Stergiopoulos

Sci Adv. 2021 May; 7(19): eabe0809. Published online 2021 May 7. doi: 10.1126/sciadv.abe0809

PMCID:: PMC8104879

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Select item 1081550114.

6-Amino-4-aryl-7-phenyl-3-(phenylimino)-4,7-dihydro-3H-[1,2]dithiolo[3,4-b]pyridine-5-carboxamides: Synthesis, Biological Activity, Quantum Chemical Studies and In Silico Docking Studies

Victor V. Dotsenko, Alexander V. Bespalov, Anna E. Sinotsko, Azamat Z. Temerdashev, Vladimir K. Vasilin, Ekaterina A. Varzieva, Vladimir D. Strelkov, Nicolai A. Aksenov, Inna V. Aksenova

Int J Mol Sci. 2024 Jan; 25(2): 769. Published online 2024 Jan 7. doi: 10.3390/ijms25020769

PMCID:: PMC10815501

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Select item 358802515.

Synthesis and Antimicrobial Evaluation of Some Novel Bis-α,β-Unsaturated Ketones, Nicotinonitrile, 1,2-Dihydropyridine-3-carbonitrile, Fused Thieno[2,3-b]pyridine and Pyrazolo[3,4-b]pyridine Derivatives

Farag M. A. Altalbawy

Int J Mol Sci. 2013 Feb; 14(2): 2967–2979. Published online 2013 Jan 30. doi: 10.3390/ijms14022967

PMCID:: PMC3588025

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Select item 800147216.

Novel Selective IDO1 Inhibitors with Isoxazolo[5,4-d]pyrimidin-4(5H)-one Scaffold

Ana Dolšak, Tomaž Bratkovič, Larisa Mlinarič, Eva Ogorevc, Urban Švajger, Stanislav Gobec, Matej Sova

Pharmaceuticals (Basel) 2021 Mar; 14(3): 265. Published online 2021 Mar 15. doi: 10.3390/ph14030265

PMCID:: PMC8001472

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Select item 903665517.

Discovery of quinolone derivatives as antimycobacterial agents

Kun-Lin Liu, Fei Teng, Lu Xiong, Xiao Li, Chao Gao, Luo-Ting Yu

RSC Adv. 2021 Jul 6; 11(39): 24095–24115. Published online 2021 Jul 8. doi: 10.1039/d0ra09250a

PMCID:: PMC9036655

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Select item 776610618.

Active Paper Sheets Including Nanoencapsulated Essential Oils: A Green Packaging Technique to Control Ethylene Production and Maintain Quality in Fresh Horticultural Products—A Case Study on Flat Peaches

Antonio López-Gómez, Alejandra Navarro-Martínez, Ginés Benito Martínez-Hernández

Foods. 2020 Dec; 9(12): 1904. Published online 2020 Dec 19. doi: 10.3390/foods9121904

PMCID:: PMC7766106

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Select item 930354119.

Behavior of counterpoise correction in many‐body molecular clusters of organic compounds: Hartree–Fock interaction energy perspective

Anh L. P. Nguyen, Ekaterina I. Izgorodina

J Comput Chem. 2022 Mar 30; 43(8): 568–576. Published online 2022 Feb 8. doi: 10.1002/jcc.26814

PMCID:: PMC9303541

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Select item 615266920.

Exploring Anti-Prion Glyco-Based and Aromatic Scaffolds: A Chemical Strategy for the Quality of Life

María Teresa Blázquez-Sánchez, Ana M. de Matos, Amélia P. Rauter

Molecules. 2017 Jun; 22(6): 864. Published online 2017 May 24. doi: 10.3390/molecules22060864

PMCID:: PMC6152669

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PMC Images search for cyanoacetamide

Fig. 3

Structure of trans cyanoacetamide, showing the two different ¹⁴N nuclei: an amide (N_a) and a cyano (N_c) nitrogen atom.

Formation of interstellar cyanoacetamide: a rotational and computational study

Astron Astrophys. ;644:A3.
Fig. 1

Energy profile in kcal/mol for the reactions of protonated hydroxilamine with cyanoacetaldehyde producing O-protonated cyanoacetamide computed at the B2PLYPD3/aug-cc-pVTZ and CCSD(T)/aug-cc-pVTZ (in parentheses) levels of theory. The zero-point vibrational energy computed at the B2PLYPD3/aug-cc-pVTZ level is included.

Formation of interstellar cyanoacetamide: a rotational and computational study

Astron Astrophys. ;644:A3.
Fig. 2

Intermediates, transition states, and products involved on the reaction of formation of protonated cyanoacetamide. Geometries are optimized at the B3PLYPD3/aug-cc-pVTZ level of theory. Bond lengths are given in Angstroms for the intermediates and TS.

Formation of interstellar cyanoacetamide: a rotational and computational study

Astron Astrophys. ;644:A3.
Scheme 3

Cyanoacetamide Starting Materials

One-Pot Synthesis of 2-Amino-indole-3-carboxamide and Analogous

ACS Comb Sci. ;13(2):140-146.