Structure Information
Structure

Compound Identification

SMILES

CC1=CC(=CC=C1)N1C(SCCCCC(=O)N2CC3(C)CC2CC(C)(C)C3)=NN=C1C1=CC=CO1

InChIKey

InChIKey=QMVLSLASBOAAKB-UHFFFAOYSA-N

Formula

C28H36N4O2S

Mass

492.68

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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 - Aryl thioether - N-acylpyrrolidine - Azepane - Alkylarylthioether - Toluene - Monocyclic benzene moiety - Benzenoid - Furan - Heteroaromatic compound - Pyrrolidine - Tertiary carboxylic acid amide - Carboxamide group - Carboxylic acid derivative - Oxacycle - Azacycle - Sulfenyl compound - Thioether - Organonitrogen compound - Organic nitrogen compound - Hydrocarbon derivative - Organooxygen compound - Organosulfur compound - Organic oxygen compound - Carbonyl group - Organic oxide - 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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