Structure Information
Structure

Compound Identification

SMILES

CN1CCN(CCCNC(=O)C2=CN=C(NC3=NC(=CS3)C3=CC(=CC=C3)C(F)(F)F)N=C2C(F)(F)F)CC1

InChIKey

InChIKey=ZBYIHCYFALKYHM-UHFFFAOYSA-N

Formula

C24H25F6N7OS

Mass

573.56

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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 heteromonocyclic compounds

Substituents

Trifluoromethylbenzene - Pyrimidinecarboxamide - Pyrimidine-5-carboxylic acid or derivatives - 2,4-disubstituted 1,3-thiazole - Aminopyrimidine - N-alkylpiperazine - N-methylpiperazine - 1,4-diazinane - Piperazine - 1,3-thiazol-2-amine - Pyrimidine - Azole - Heteroaromatic compound - Thiazole - Amino acid or derivatives - Carboxamide group - Tertiary aliphatic amine - Tertiary amine - Secondary carboxylic acid amide - Carboxylic acid derivative - Azacycle - Organoheterocyclic compound - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Hydrocarbon derivative - Alkyl fluoride - Organic oxide - Organic oxygen compound - Alkyl halide - Amine - Organic nitrogen compound - Aromatic heteromonocyclic 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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