Structure Information
Structure

Compound Identification

SMILES

[O-]C1=NC(S)=C(C#N)C([C@H]1[N+]1=CC=CC=C1)C1=CC(Br)=C(F)C=C1

InChIKey

InChIKey=NTGCZZBUBZTSQP-YSSOQSIOSA-N

Formula

C17H11BrFN3OS

Mass

404.26

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Halobenzenes

Intermediate Tree Nodes

Not available

Direct Parent

Fluorobenzenes

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Bromobenzene - Dihydropyridine - Fluorobenzene - Aryl bromide - Aryl fluoride - Aryl halide - Hydropyridine - Pyridine - Pyridinium - Heteroaromatic compound - Cyclic carboximidic acid - Ketene acetal or derivatives - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Alkylthiol - Organoheterocyclic compound - Azacycle - Carbonitrile - Nitrile - Organic salt - Organobromide - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Hydrocarbon derivative - Organic oxide - Cyanide - Organic oxygen compound - Organic nitrogen compound - Organic zwitterion - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as fluorobenzenes. These are compounds containing one or more fluorine atoms attached to a benzene ring.

External Descriptors

Not available

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