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Record W4294713470 · doi:10.1002/mrc.5308

Synthesis and characterization of novel conformers of ( <i>E</i> ) <i>‐</i> 2‐(3‐nitro‐ <i>H</i> ‐imidazo[1,2‐ <i>a</i> ]pyridin‐2‐ylthio)‐ <i>N</i> ′‐benzylideneacetohydrazide derivatives

2022· article· en· W4294713470 on OpenAlexaff
Ablo Evrard, Souleymane Coulibaly, Siomenan Coulibali, Kouassi Signo, Patrick‐Armand Achi, Nicolas Giraud, Gildas Bertho

Bibliographic record

VenueMagnetic Resonance in Chemistry · 2022
Typearticle
Languageen
FieldChemistry
TopicSynthesis and Characterization of Heterocyclic Compounds
Canadian institutionsUniversité du Québec à Montréal
Fundersnot available
KeywordsChemistryConformational isomerismNitroBenzaldehydeStereochemistryPyridineHydrazoneNuclear magnetic resonance spectroscopyProton NMRTwo-dimensional nuclear magnetic resonance spectroscopyMedicinal chemistryMoleculeOrganic chemistryCatalysis

Abstract

fetched live from OpenAlex

Abstract Eighteen new N ‐acylhydrazones ( 9a–r ) containing the imidazo[1,2‐ a ]pyridine scaffold were synthesized through a seven steps reaction sequence, ending with a condensation of 2‐(3‐nitro‐ H ‐imidazo[1,2‐ a ]pyridin‐2‐ylthio)acetohydrazide with various benzaldehyde derivatives ( 8a–r ). All synthesized compounds were characterized by 1D NMR ( 1 H and 13 C NMR) and 2D NMR (NOESY) spectroscopic analyses and high‐resolution mass spectrometry (HRMS). The analysis of 1 H NMR data performed at room temperature in deuterated dimethylsulfoxide (DMSO‐ d 6 ) revealed the presence of ( E ) ‐ 2‐(3‐nitro‐ H ‐imidazo[1,2‐ a ]pyridin‐2‐ylthio)‐ N ′‐benzylideneacetohydrazide ( 9a–r ) as a mixture of two conformers, namely, syn‐periplanar E ( sp E ) and anti‐periplanar E ( ap E ). For all N ‐acylhydrazones that were synthesized, the sp E conformer was found to be the major form except in the case of hydrazone derived from o ‐hydroxybenzaldehyde.

Fetched live from OpenAlex and de-inverted. Abstracts are not stored in this database: the inverted indexes are 8.6 GB of the frame’s 9.3 GB of text, and the host has 13 GB free.

How this classification was reachedexpand

Full frame machine prediction

Teacher imitation

Not calibrated prevalence, not ground truth. Human validation pending. The Gemma side is a direct model label for every work in the frame, read from the title-only record. The Codex side is a classifier learned from the 10,348 direct Codex labels and calibrated to design-weighted sample rates; fields without enough sample support carry no Codex call. Candidate is the union of the two sides; consensus is their intersection. These outputs are machine_predicted_unvalidated and are not human labels.

metaresearch head score (Codex)0.000
metaresearch head score (Gemma)0.000
Version: metacan-v3-hybrid-931329e0061cValidation status: machine_predicted_unvalidated
Candidate categoriesnone
Consensus categoriesnone
DomainCandidate signal: none · Consensus signal: none
Study designCandidate signal: Bench or experimental · Consensus signal: Bench or experimental
GenreCandidate signal: Empirical · Consensus signal: Empirical
Teacher disagreement score0.001
Threshold uncertainty score0.002

Distilled classifier scores by category (both heads)

CategoryCodexGemma
Metaresearch0.0000.000
Meta-epidemiology (narrow)0.0000.000
Meta-epidemiology (broad)0.0000.000
Bibliometrics0.0000.000
Science and technology studies0.0000.000
Scholarly communication0.0000.000
Open science0.0000.000
Research integrity0.0000.000
Insufficient payload (model declined to judge)0.0010.000

Machine scores (provisional)

The two teacher heads of the student model, read on this work. A score orders the frame for review; it never asserts a category, and the validation status ships verbatim with every row.

Baseline scores from an immature model (maturity gate not passed, 7 training rounds). Scores rank; they never assert a category.

Opus teacher head0.011
GPT teacher head0.211
Teacher spread0.200 · how far apart the two teachers sit on this one work
Validation statusscore_only:v0-immature-baseline · verbatim from the scoring run: score_only means the number may rank works, and no category label ships from it

Classification

machine, unvalidated

Machine predicted; a candidate call from one source (direct Gemma or distilled Codex), not a consensus.

The models applied no category: nothing in the taxonomy fit this work.
Study designBench or experimental
Domainnot available
GenreEmpirical

How this classification was reached, model by model and score by score, is at the end of the page under "How this classification was reached".

Quick stats

Citations2
Published2022
Admission routes1
Has abstractyes

Explore more

Same venueMagnetic Resonance in ChemistrySame topicSynthesis and Characterization of Heterocyclic CompoundsFrench-language works237,207