Structure Information
Structure

Compound Identification

SMILES

CC(C)N1N=NC2=C1C=C(C=C2)C1=C(N=CO1)C1=CC(Br)=C(F)C=C1

InChIKey

InChIKey=KTDMKPXENFKZMI-UHFFFAOYSA-N

Formula

C18H14BrFN4O

Mass

401.239

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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 - Benzotriazole - 4,5-disubstituted 1,3-oxazole - Bromobenzene - Fluorobenzene - Halobenzene - Aryl bromide - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Heteroaromatic compound - 1,2,3-triazole - Triazole - Oxacycle - Azacycle - Organofluoride - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organopnictogen compound - Organic oxygen compound - Organohalogen compound - Organobromide - 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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