Structure Information
Structure

Compound Identification

SMILES

O[N+]1=CC=CC=C1C(F)(F)CNC1=NC=CC(CC(=O)NCC2=C(C=CC(Cl)=C2)N2C=NC=N2)=C1F

InChIKey

InChIKey=LGLNCQVVGMTRJZ-UHFFFAOYSA-O

Formula

C23H20ClF3N7O2

Mass

518.9

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Azoles

Subclass

Triazoles

Intermediate Tree Nodes

Phenyltriazoles

Direct Parent

Phenyl-1,2,4-triazoles

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Phenyl-1,2,4-triazole - Aminopyridine - Chlorobenzene - Halobenzene - Aryl chloride - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Pyridine - Pyridinium - Benzenoid - Imidolactam - Heteroaromatic compound - Secondary carboxylic acid amide - Carboxamide group - Azacycle - Carboxylic acid derivative - Organooxygen compound - Amine - Organohalogen compound - Organic oxide - Organic oxygen compound - Organochloride - Organofluoride - Carbonyl group - Organic nitrogen compound - Alkyl fluoride - Organonitrogen compound - Hydrocarbon derivative - Alkyl halide - Organic cation - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as phenyl-1,2,4-triazoles. These are organic compounds containing a 1,2,4-triazole substituted by a phenyl group.

External Descriptors

Not available

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