Structure Information
Structure

Compound Identification

SMILES

CC1(CNS(C)(=O)=O)COC(OC1)C1=NC(=C(N1)C1=NC(NC2CC2)=NC=C1)C1=CC=C(F)C=C1

InChIKey

InChIKey=LMPAWLCAGSCGLY-UHFFFAOYSA-N

Formula

C23H27FN6O4S

Mass

502.57

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Azoles

Subclass

Imidazoles

Intermediate Tree Nodes

Substituted imidazoles

Direct Parent

Phenylimidazoles

Alternative Parents

2,4,5-trisubstituted imidazoles Secondary alkylarylamines Aminopyrimidines and derivatives Fluorobenzenes 1,3-dioxanes Organosulfonamides Organic sulfonamides Aryl fluorides Aminosulfonyl compounds Heteroaromatic compounds Azacyclic compounds Oxacyclic compounds Acetals Organic oxides Organofluorides Hydrocarbon derivatives Organopnictogen compounds

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

5-phenylimidazole - 4-phenylimidazole - 2,4,5-trisubstituted-imidazole - Trisubstituted imidazole - Aminopyrimidine - Fluorobenzene - Halobenzene - Secondary aliphatic/aromatic amine - Meta-dioxane - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Pyrimidine - Organic sulfonic acid amide - Organosulfonic acid amide - Benzenoid - Aminosulfonyl compound - Heteroaromatic compound - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Oxacycle - Azacycle - Acetal - Organic oxygen compound - Organohalogen compound - Organic oxide - Organopnictogen compound - Organofluoride - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Hydrocarbon derivative - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as phenylimidazoles. These are polycyclic aromatic compounds containing a benzene ring linked to an imidazole ring through a CC or CN bond.

External Descriptors

Not available

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