Structure Information
Structure

Compound Identification

SMILES

NC1=C(SC(NC2=CC(F)=CC=C2)=C1C#N)C(=O)C1=CC=C(Br)C=C1

InChIKey

InChIKey=KHEJJAZEIRGHEZ-UHFFFAOYSA-N

Formula

C18H11BrFN3OS

Mass

416.27

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organic oxygen compounds

Class

Organooxygen compounds

Subclass

Carbonyl compounds

Intermediate Tree Nodes

Ketones - Aryl ketones - Phenylketones

Direct Parent

Aryl-phenylketones

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Aryl-phenylketone - 3,4,5-trisubstituted-2-aminothiophene - Benzoyl - Thiophene carboxylic acid or derivatives - Aniline or substituted anilines - Bromobenzene - Fluorobenzene - Halobenzene - N-arylated-2-aminothiophene - Aminothiophene - Aryl bromide - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Benzenoid - 2-aminothiophene - Vinylogous amide - Thiophene - Heteroaromatic compound - Organoheterocyclic compound - Secondary amine - Nitrile - Carbonitrile - Primary amine - Hydrocarbon derivative - Organic oxide - Cyanide - Organic nitrogen compound - Organohalogen compound - Organobromide - Organofluoride - Amine - Organonitrogen compound - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as aryl-phenylketones. These are aromatic compounds containing a ketone substituted by one aryl group, and a phenyl group.

External Descriptors

Not available

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