Structure Information
Structure

Compound Identification

SMILES

COC1=CC(OC)=CC(NC(=O)CSC2=NN=C(N2C2=CC=C(Br)C=C2)C2=CC=NC=C2)=C1

InChIKey

InChIKey=XKTAOQILFKCFPH-UHFFFAOYSA-N

Formula

C23H20BrN5O3S

Mass

526.41

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Pyridines and derivatives

Subclass

Pyridyltriazoles

Intermediate Tree Nodes

Not available

Direct Parent

Pyridyl-1,2,4-triazoles

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Phenyltriazole - Phenyl-1,2,4-triazole - Pyridyl-1,2,4-triazole - Dimethoxybenzene - M-dimethoxybenzene - Methoxyaniline - Anilide - Methoxybenzene - Phenol ether - Aryl thioether - Phenoxy compound - N-arylamide - Anisole - Bromobenzene - Halobenzene - Alkylarylthioether - Alkyl aryl ether - Aryl halide - Monocyclic benzene moiety - Benzenoid - Aryl bromide - Azole - Heteroaromatic compound - 1,2,4-triazole - Triazole - Secondary carboxylic acid amide - Carboxamide group - Thioether - Azacycle - Carboxylic acid derivative - Sulfenyl compound - Ether - Organic oxide - Organohalogen compound - Organobromide - Carbonyl group - Organonitrogen compound - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organooxygen compound - Organosulfur compound - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as pyridyl-1,2,4-triazoles. These are organic compounds containing a pyridine ring attached to a 1,2,4-triazole ring.

External Descriptors

Not available

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