Structure Information
Structure

Compound Identification

SMILES

CC1=CC2=C(C=C1)N=C(NC(=O)CSC1=CN(CCNC(=O)C3=CC(=CC=C3)C(F)(F)F)C3=CC=CC=C13)S2

InChIKey

InChIKey=XWDXDACOWNHGFR-UHFFFAOYSA-N

Formula

C28H23F3N4O2S2

Mass

568.63

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Trifluoromethylbenzenes

Intermediate Tree Nodes

Not available

Direct Parent

Trifluoromethylbenzenes

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Trifluoromethylbenzene - N-alkylindole - Benzamide - Benzoic acid or derivatives - 1,3-benzothiazole - Indole - Indole or derivatives - Aryl thioether - Benzoyl - N-arylamide - Alkylarylthioether - Substituted pyrrole - Azole - Heteroaromatic compound - Pyrrole - Thiazole - Carboxamide group - Secondary carboxylic acid amide - Thioether - Azacycle - Carboxylic acid derivative - Organoheterocyclic compound - Sulfenyl compound - Alkyl halide - Organohalogen compound - Organofluoride - Organonitrogen compound - Alkyl fluoride - Carbonyl group - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organosulfur compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as trifluoromethylbenzenes. These are organofluorine compounds that contain a benzene ring substituted with one or more trifluoromethyl groups.

External Descriptors

Not available

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