Structure Information
Structure

Compound Identification

SMILES

COC1=CC(=CC(OC)=C1)C(=O)NCC1=NN=C(SCC2=CC=C(Br)C=C2)N1C1=CC(Cl)=CC=C1

InChIKey

InChIKey=GEJSTHZGQXFKOP-UHFFFAOYSA-N

Formula

C25H22BrClN4O3S

Mass

573.89

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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 - M-dimethoxybenzene - Dimethoxybenzene - Benzamide - Benzoic acid or derivatives - Anisole - Phenoxy compound - Aryl thioether - Benzoyl - Phenol ether - Methoxybenzene - Alkyl aryl ether - Bromobenzene - Chlorobenzene - Halobenzene - Alkylarylthioether - Aryl chloride - Benzenoid - Aryl halide - Aryl bromide - Monocyclic benzene moiety - Heteroaromatic compound - Secondary carboxylic acid amide - Carboxamide group - Azacycle - Sulfenyl compound - Thioether - Ether - Carboxylic acid derivative - Organosulfur compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organohalogen compound - Organobromide - Organochloride - Organonitrogen compound - Organooxygen compound - 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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