Structure Information
Structure

Compound Identification

SMILES

CC1=CC=CC(=C1)C1=NOC(=N1)C1CCCN1C(=O)NC1=CC(Br)=CC=C1

InChIKey

InChIKey=WDMSKPIAMWWSDP-UHFFFAOYSA-N

Formula

C20H19BrN4O2

Mass

427.302

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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 - N-phenylurea - Pyrrolidine carboxylic acid or derivatives - Pyrrolidine-1-carboxamide - Bromobenzene - Halobenzene - Toluene - Benzenoid - Aryl halide - Monocyclic benzene moiety - Aryl bromide - Pyrrolidine - Heteroaromatic compound - Urea - Azacycle - Oxacycle - Hydrocarbon derivative - Organobromide - Organohalogen compound - Organic nitrogen compound - Organonitrogen compound - Carbonyl group - Organooxygen compound - Organic oxygen compound - Organic oxide - 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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