Structure Information
Structure

Compound Identification

SMILES

COC(=O)C1=CC=CC=C1NC1=NC(=CC(NC2=NNC(C)=C2)=N1)N1CCN(CC1)S(=O)(=O)C(F)(F)F

InChIKey

InChIKey=KKXAJDHKOCIPJL-UHFFFAOYSA-N

Formula

C21H23F3N8O4S

Mass

540.52

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Diazinanes

Subclass

Piperazines

Intermediate Tree Nodes

Not available

Direct Parent

N-arylpiperazines

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

N-arylpiperazine - Benzoate ester - Benzoic acid or derivatives - Benzoyl - Aniline or substituted anilines - Dialkylarylamine - Aminopyrimidine - Monocyclic benzene moiety - Pyrimidine - Organic sulfonic acid amide - Organosulfonic acid amide - Imidolactam - Benzenoid - Azole - Pyrazole - Organic sulfonic acid or derivatives - Heteroaromatic compound - Organosulfonic acid or derivatives - Sulfonyl - Vinylogous amide - Methyl ester - Trihalomethane - Carboxylic acid ester - Azacycle - Carboxylic acid derivative - Organic oxide - Organofluoride - Organohalogen compound - Organonitrogen compound - Organooxygen compound - Halomethane - Organosulfur compound - Hydrocarbon derivative - Amine - Organic nitrogen compound - Alkyl halide - Alkyl fluoride - Organic oxygen compound - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as n-arylpiperazines. These are organic compounds containing a piperazine ring where the nitrogen ring atom carries an aryl group.

External Descriptors

Not available

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