Structure Information
Structure

Compound Identification

SMILES

N#CC1=CC=C(C=C1)C1=NC(=NO1)N1CCCC1

InChIKey

InChIKey=XINOKHJWDBWGIJ-UHFFFAOYSA-N

Formula

C13H12N4O

Mass

240.266

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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 - Benzonitrile - Dialkylarylamine - Monocyclic benzene moiety - Benzenoid - Pyrrolidine - Heteroaromatic compound - Azacycle - Nitrile - Carbonitrile - Oxacycle - Hydrocarbon derivative - Cyanide - Amine - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - 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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