Structure Information
Structure

Compound Identification

SMILES

COC1=CC(=CC(OC)=C1OC)C1=NN=C(CSC2=NN=C(NC3=CC=C(C=C3)C(C)C)S2)O1

InChIKey

InChIKey=RAIOPVNVVOYZBU-UHFFFAOYSA-N

Formula

C23H25N5O4S2

Mass

499.6

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Cumenes

Intermediate Tree Nodes

Not available

Direct Parent

Cumenes

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Phenylpropane - Cumene - Phenoxy compound - Aryl thioether - Phenol ether - Anisole - Aniline or substituted anilines - Methoxybenzene - Alkyl aryl ether - Alkylarylthioether - 2-amino-5-substituted-1,3,4-thiadiazole - 2-amino-1,3,4-thiadiazole - Oxadiazole - Heteroaromatic compound - Thiadiazole - 1,3,4-oxadiazole - Azole - Oxacycle - Azacycle - Ether - Organoheterocyclic compound - Sulfenyl compound - Thioether - Secondary amine - Amine - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organopnictogen compound - Hydrocarbon derivative - Organic nitrogen compound - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as cumenes. These are aromatic compounds containing a prop-2-ylbenzene moiety.

External Descriptors

Not available

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