Structure Information
Structure

Compound Identification

SMILES

COC1=C(OC)C=C(C=C1)C1=NN2C(=O)C(SC2=N1)=C1C(=O)N(CC2=CC=CC=C2Cl)C2=CC=CC=C12

InChIKey

InChIKey=COWRKIFCPIYCAP-UHFFFAOYSA-N

Formula

C27H19ClN4O4S

Mass

530.98

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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 - O-dimethoxybenzene - Dimethoxybenzene - Indole or derivatives - Phenoxy compound - Anisole - Phenol ether - Methoxybenzene - Triazolothiazole - Alkyl aryl ether - Halobenzene - Chlorobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Tertiary carboxylic acid amide - Thiazole - Heteroaromatic compound - Carboxamide group - Lactam - Azacycle - Carboxylic acid derivative - Ether - Organonitrogen compound - Organic oxygen compound - Organooxygen compound - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organochloride - Organohalogen compound - 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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