Structure Information
Structure

Compound Identification

SMILES

COC1=C\C(C=CC1=O)=C1\NN=C(N)S1

InChIKey

InChIKey=WJLRKAZYXAWXLC-YVMONPNESA-N

Formula

C9H9N3O2S

Mass

223.25

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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

Aliphatic heteromonocyclic compounds

Substituents

P-quinomethane - Thiadiazoline - Ketene acetal or derivatives - Azacycle - Organoheterocyclic compound - Hydrazone - Organic nitrogen compound - Organic oxide - Hydrocarbon derivative - Organonitrogen compound - Amine - Aliphatic 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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