Compound Identification
SMILES
ClC1=CC(Cl)=C(SC(CC(=O)C2=CC=CC=C2)C2=CC=CC=C2)C=C1
InChIKey
InChIKey=URMYTRQREOANTC-UHFFFAOYSA-N
Formula
C21H16Cl2OS
Mass
387.32
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Phenylpropanoids and polyketides
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Class
Linear 1,3-diarylpropanoids
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Subclass
Chalcones and dihydrochalcones
- Level 5 Retro-dihydrochalcones
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Subclass
Chalcones and dihydrochalcones
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Class
Linear 1,3-diarylpropanoids
-
Superclass
Phenylpropanoids and polyketides
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
Alkyl-phenylketones Butyrophenones Thiophenol ethers Dichlorobenzenes Benzoyl derivatives Aryl alkyl ketones Alkylarylthioethers Aryl chlorides Sulfenyl compounds Organochlorides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Retro-dihydrochalcone - Alkyl-phenylketone - Butyrophenone - Phenylketone - Aryl thioether - Benzoyl - 1,3-dichlorobenzene - Thiophenol ether - Aryl alkyl ketone - Aryl ketone - Chlorobenzene - Halobenzene - Alkylarylthioether - Aryl chloride - Monocyclic benzene moiety - Aryl halide - Benzenoid - Ketone - Thioether - Sulfenyl compound - Organosulfur compound - Organooxygen compound - Organochloride - Organohalogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Aromatic homomonocyclic 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