Structure Information
Structure

Compound Identification

SMILES

FC(F)(F)OC1=CC=CC=C1C1=NOC(=N1)[C@@H]1CCCN1C(=O)C1=C(C=CC(Cl)=C1)N1N=CC=N1

InChIKey

InChIKey=HSINAKNHTYNXPR-KRWDZBQOSA-N

Formula

C22H16ClF3N6O3

Mass

504.85

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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

Phenyltriazole - Phenyl-1,2,4-oxadiazole - Phenyl-1,2,3-triazole - 3-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Benzamide - Benzoic acid or derivatives - Benzoyl - Phenol ether - Phenoxy compound - N-acylpyrrolidine - Halobenzene - Chlorobenzene - Aryl chloride - Benzenoid - Aryl halide - Monocyclic benzene moiety - Heteroaromatic compound - 1,2,3-triazole - Triazole - Tertiary carboxylic acid amide - Pyrrolidine - Trihalomethane - Carboxamide group - Oxacycle - Azacycle - Carboxylic acid derivative - Organonitrogen compound - Organooxygen compound - Alkyl halide - Alkyl fluoride - Hydrocarbon derivative - Halomethane - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organofluoride - Organohalogen compound - Organochloride - 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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