Structure Information
Structure

Compound Identification

SMILES

COC1=C(OC)C=C(CCNC(=O)C2=CSC(CSC3=NN=C(N3C3=CC=CC=C3F)C3=CC=CC=C3Cl)=N2)C=C1

InChIKey

InChIKey=IUBPNVQVIPUSDL-UHFFFAOYSA-N

Formula

C29H25ClFN5O3S2

Mass

610.12

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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 - Dimethoxybenzene - O-dimethoxybenzene - 2-heteroaryl carboxamide - Anisole - Phenoxy compound - Aryl thioether - Phenol ether - Thiazolecarboxamide - Thiazolecarboxylic acid or derivatives - Methoxybenzene - 2,4-disubstituted 1,3-thiazole - Alkyl aryl ether - Chlorobenzene - Fluorobenzene - Halobenzene - Alkylarylthioether - Aryl fluoride - Benzenoid - Aryl halide - Monocyclic benzene moiety - Aryl chloride - Thiazole - Heteroaromatic compound - Secondary carboxylic acid amide - Carboxamide group - Azacycle - Sulfenyl compound - Thioether - Carboxylic acid derivative - Ether - Hydrocarbon derivative - Organic nitrogen compound - Organohalogen compound - Organochloride - Organofluoride - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic oxygen compound - Organic oxide - 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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