Structure Information
Structure

Compound Identification

SMILES

BrC1=C(C(=O)NC2CN3CCC2CC3)C2=C(OC(=N2)C2=CC=CC=C2)C=C1

InChIKey

InChIKey=TWKJQYYTHDGIIM-UHFFFAOYSA-N

Formula

C21H20BrN3O2

Mass

426.314

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Azoles

Subclass

Oxazoles

Intermediate Tree Nodes

Not available

Direct Parent

Phenyl-1,3-oxazoles

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Phenyl-1,3-oxazole - Halobenzoic acid or derivatives - 2-halobenzoic acid or derivatives - Benzoxazole - Quinuclidine - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Piperidine - Benzenoid - Heteroaromatic compound - Vinylogous halide - Amino acid or derivatives - Carboxamide group - Secondary carboxylic acid amide - Tertiary amine - Tertiary aliphatic amine - Carboxylic acid derivative - Oxacycle - Azacycle - Organooxygen compound - Organonitrogen compound - Organobromide - Organohalogen compound - Amine - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Organic oxygen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as phenyl-1,3-oxazoles. These are aromatic heterocyclic compounds containing a 1,3-oxazole substituted at one or more positions by a phenyl group.

External Descriptors

Not available

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