Structure Information
Structure

Compound Identification

SMILES

COC1=CC=C(C=C1)C(=O)CC(C1C(=O)NC(=S)NC1=O)C1=CC=C(C)C=C1

InChIKey

InChIKey=JDFVZJCHTLEZLY-UHFFFAOYSA-N

Formula

C21H20N2O4S

Mass

396.46

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Phenylpropanoids and polyketides

Class

Linear 1,3-diarylpropanoids

Subclass

Chalcones and dihydrochalcones

Intermediate Tree Nodes

Not available

Direct Parent

Retro-dihydrochalcones

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Retro-dihydrochalcone - Alkyl-phenylketone - Butyrophenone - Monocyclic monoterpenoid - Monoterpenoid - P-cymene - Aromatic monoterpenoid - Thiobarbiturate - Phenylketone - Benzoyl - Aryl alkyl ketone - Aryl ketone - Phenoxy compound - Phenol ether - Anisole - Methoxybenzene - Toluene - Alkyl aryl ether - Benzenoid - 1,3-dicarbonyl compound - 1,3-diazinane - Monocyclic benzene moiety - Thiourea - Ketone - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Ether - Carbonyl group - Organosulfur compound - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organooxygen compound - Organic oxide - Organonitrogen compound - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as retro-dihydrochalcones. These are a form of normal dihydrochalcones that are structurally distinguished by the lack of oxygen functionalities at the C2'- and C6'-positions.

External Descriptors

Not available

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