Structure Information
Structure

Compound Identification

SMILES

CCCCC1=CC=C(NCC2=NC(=NO2)C2=CC=C(C)C=C2)C=C1

InChIKey

InChIKey=OUQNMLIEQQZELJ-UHFFFAOYSA-N

Formula

C20H23N3O

Mass

321.424

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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

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Phenyl-1,2,4-oxadiazole - Phenylalkylamine - Aniline or substituted anilines - Secondary aliphatic/aromatic amine - Toluene - Aralkylamine - Monocyclic benzene moiety - Benzenoid - Heteroaromatic compound - Secondary amine - Oxacycle - Azacycle - Amine - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic nitrogen compound - Aromatic heteromonocyclic 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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