Structure Information
Structure

Compound Identification

SMILES

CSC1=NC(=O)N\C(N1)=C1\C=CC(=O)C(O)=C1

InChIKey

InChIKey=BYWBTNMXVRVCLS-VMPITWQZSA-N

Formula

C10H9N3O3S

Mass

251.26

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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 - Triazinone - Triazine - 1,3,5-triazine - Isothiourea - Ketene acetal or derivatives - Enol - Azacycle - Organoheterocyclic compound - Carboximidamide - Sulfenyl compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Hydrocarbon derivative - Imine - Organic nitrogen compound - Organic oxide - Organonitrogen compound - Organosulfur compound - 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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