Structure Information
Structure

Compound Identification

SMILES

CCCC1=NN2C(S1)=NC(=O)C(C=C1C=CC(=O)C(OC)=C1)=C2N

InChIKey

InChIKey=LKCFUQKWVZKLHE-UHFFFAOYSA-N

Formula

C16H16N4O3S

Mass

344.39

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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 heteropolycyclic compounds

Substituents

P-quinomethane - Aminopyrimidine - Pyrimidone - Pyrimidine - Azole - Heteroaromatic compound - Vinylogous amide - Thiadiazole - Azacycle - Organoheterocyclic compound - Primary amine - Hydrocarbon derivative - Organonitrogen compound - Organic oxide - Amine - Organic nitrogen compound - Aromatic heteropolycyclic 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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