Structure Information
Structure

Compound Identification

SMILES

COC1=CC=C(C=C1)C1=NN=C(SCC(=O)NN\C=C2/C=NC3=CC=CC=C23)N1C1=CC=CC(=C1)C(F)(F)F

InChIKey

InChIKey=KOIGFTQWBBDONW-OBGWFSINSA-N

Formula

C27H21F3N6O2S

Mass

550.56

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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 heteropolycyclic compounds

Substituents

Phenyl-1,2,4-triazole - Trifluoromethylbenzene - Indole or derivatives - Anisole - Phenol ether - Phenoxy compound - Methoxybenzene - Aryl thioether - Alkyl aryl ether - Alkylarylthioether - Benzenoid - Monocyclic benzene moiety - Heteroaromatic compound - Carboxylic acid hydrazide - Azacycle - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Sulfenyl compound - Thioether - Carboxylic acid derivative - Ether - Organic oxygen compound - Organofluoride - Organohalogen compound - Organic nitrogen compound - Imine - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Carbonyl group - Alkyl fluoride - Alkyl halide - Hydrocarbon derivative - Organic oxide - Aromatic heteropolycyclic 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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