Structure Information
Structure

Compound Identification

SMILES

CN(C1N(C)C(=NC1(C(F)(F)F)C(F)(F)F)C1=CC=C(C=C1)C#N)C(=O)C(F)(F)SC1=CC=CC=C1

InChIKey

InChIKey=KMACADVZMDBIMO-UHFFFAOYSA-N

Formula

C22H16F8N4OS

Mass

536.44

Export to:

JSON SDF CSV

Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Benzonitriles

Intermediate Tree Nodes

Not available

Direct Parent

Benzonitriles

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Benzonitrile - Aryl thioether - Thiophenol ether - Alkylarylthioether - Imidolactam - 2-imidazoline - Tertiary carboxylic acid amide - Carboxamide group - Organoheterocyclic compound - Azacycle - Amidine - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Sulfenyl compound - Carboximidamide - Carboxylic acid amidine - Thioether - Carboxylic acid derivative - Carbonitrile - Nitrile - Hydrocarbon derivative - Organofluoride - Organohalogen compound - Organonitrogen compound - Organooxygen compound - Alkyl fluoride - Organosulfur compound - Alkyl halide - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Cyanide - Organic oxide - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as benzonitriles. These are organic compounds containing a benzene bearing a nitrile substituent.

External Descriptors

Not available

Previous Back Next