Structure Information
Structure

Compound Identification

SMILES

COC1=CC(=CNNC(=O)CSC2NNC(N2C2=CC=C(Cl)C=C2)C2=CC=C(C)C=C2)C=C(OC)C1=O

InChIKey

InChIKey=KSCCPKLZMAESMC-UHFFFAOYSA-N

Formula

C26H28ClN5O4S

Mass

542.05

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organic oxygen compounds

Class

Organooxygen compounds

Subclass

Carbonyl compounds

Intermediate Tree Nodes

Ketones - Cyclic ketones - Quinomethanes

Direct Parent

P-quinomethanes

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

P-quinomethane - Dialkylarylamine - Chlorobenzene - Halobenzene - Toluene - Monocyclic benzene moiety - Aryl chloride - Aryl halide - Benzenoid - Triazolidine - Carboxylic acid hydrazide - Dialkylthioether - Organoheterocyclic compound - Thioether - Sulfenyl compound - Azacycle - Carboxylic acid derivative - Alkylhydrazine - Organic nitrogen compound - Organohalogen compound - Hydrazine derivative - Organopnictogen compound - Organochloride - Organonitrogen compound - Organosulfur compound - Hydrocarbon derivative - Organic oxide - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as p-quinomethanes. These are organic compounds containing a benzene ring conjugated to a methylidene group and a ketone at carbon atoms 1 and 4, respectively.

External Descriptors

Not available

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