Structure Information
Structure

Compound Identification

SMILES

ClC1=CC=CC=C1C1=NN=C(SCC(=O)NC2=CC=C(Br)C=C2)N1CC1=CC=CO1

InChIKey

InChIKey=UTBCQHXQPVWNBN-UHFFFAOYSA-N

Formula

C21H16BrClN4O2S

Mass

503.8

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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 - Anilide - N-arylamide - Aryl thioether - Halobenzene - Alkylarylthioether - Chlorobenzene - Bromobenzene - Aryl halide - Benzenoid - Aryl chloride - Aryl bromide - Monocyclic benzene moiety - Furan - Heteroaromatic compound - Secondary carboxylic acid amide - Carboxamide group - Oxacycle - Carboxylic acid derivative - Azacycle - Sulfenyl compound - Thioether - Organohalogen compound - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organobromide - Organochloride - Organonitrogen compound - Organooxygen compound - Organosulfur 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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