Structure Information
Structure

Compound Identification

SMILES

CC1=CC=C(NC(=O)N2CC3=C(CC2C2=NC(=NO2)C2=CC(=CC=C2)N(=O)=O)N=CN3)C=C1

InChIKey

InChIKey=OFRROZNHFKWTIB-UHFFFAOYSA-N

Formula

C22H19N7O4

Mass

445.439

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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 heteropolycyclic compounds

Substituents

Phenyl-1,2,4-oxadiazole - N-phenylurea - Imidazopiperidine - Imidazopyridine - Nitrobenzene - Pyridinecarboxamide - Nitroaromatic compound - Toluene - Monocyclic benzene moiety - Benzenoid - Imidazole - Heteroaromatic compound - C-nitro compound - Organic nitro compound - Urea - Oxacycle - Azacycle - Organic oxoazanium - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Carbonyl group - Organic salt - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organic cation - 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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