Structure Information
Structure

Compound Identification

SMILES

C[C@@H]1CCCN1CCC1=CC2=C(O1)C=CC(=C2)C1=NOC(=N1)C1=CC=C(F)C=C1

InChIKey

InChIKey=AYBKWLIHGFBJJT-OAHLLOKOSA-N

Formula

C23H22FN3O2

Mass

391.446

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Azoles

Subclass

Oxadiazoles

Intermediate Tree Nodes

1,2,4-oxadiazoles

Direct Parent

Phenyloxadiazoles

Alternative Parents

Benzofurans Fluorobenzenes Aralkylamines N-alkylpyrrolidines Aryl fluorides Heteroaromatic compounds Furans Trialkylamines Oxacyclic compounds Azacyclic compounds Organooxygen compounds Organofluorides Hydrocarbon derivatives

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Phenyl-1,2,4-oxadiazole - Benzofuran - Fluorobenzene - Halobenzene - Aralkylamine - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Benzenoid - N-alkylpyrrolidine - Heteroaromatic compound - Furan - Pyrrolidine - Tertiary amine - Tertiary aliphatic amine - Azacycle - Oxacycle - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Amine - Hydrocarbon derivative - Organic oxygen compound - Organic nitrogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as phenyloxadiazoles. These are polycyclic aromatic compounds containing a benzene ring linked to a 1,2,4-oxadiazole ring through a CC or CN bond.

External Descriptors

Not available

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