Structure Information
Structure

Compound Identification

SMILES

COCCN1C(=O)C2=C(N=CN2C2=C1C=C(Cl)C=C2)C1=NOC(=N1)C1=C(F)C=C(F)C=C1

InChIKey

InChIKey=CTSKVZHRRRXBNC-UHFFFAOYSA-N

Formula

C21H14ClF2N5O3

Mass

457.82

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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 - Quinoxaline - Imidazo[1,5-a]pyrazine - Fluorobenzene - Halobenzene - Aryl chloride - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Pyrazine - N-substituted imidazole - Heteroaromatic compound - Imidazole - Lactam - Dialkyl ether - Ether - Oxacycle - Azacycle - Organooxygen compound - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organonitrogen compound - Organofluoride - Organohalogen compound - Organochloride - 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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