Structure Information
Structure

Compound Identification

SMILES

COC1=CC=CC(CSC2=NN=C(C(C)NC(=O)NC3=C(C)C=CC=C3C)N2C2=C(C)C=CC(Cl)=C2)=C1

InChIKey

InChIKey=UWTFLJKXHMZJEP-UHFFFAOYSA-N

Formula

C28H30ClN5O2S

Mass

536.09

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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 - N-phenylurea - Phenoxy compound - Aryl thioether - Anisole - M-xylene - Xylene - Phenol ether - Methoxybenzene - Alkyl aryl ether - Halobenzene - Toluene - Alkylarylthioether - Chlorobenzene - Aryl chloride - Aryl halide - Benzenoid - Monocyclic benzene moiety - Heteroaromatic compound - Urea - Azacycle - Sulfenyl compound - Ether - Thioether - Organosulfur compound - Organic oxide - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Organohalogen compound - 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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