Compound Identification
SMILES
CSC1=CC=C(C=CC(=O)C2=CC=C(C=C2)N2CCOCC2)C=C1
InChIKey
InChIKey=VLUPROJXHBBMEW-UHFFFAOYSA-N
Formula
C20H21NO2S
Mass
339.45
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
-
Class
Linear 1,3-diarylpropanoids
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Subclass
Chalcones and dihydrochalcones
- Level 5 Retrochalcones
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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
Retrochalcones
Alternative Parents
Phenylmorpholines Cinnamic acids and derivatives Thiophenol ethers Styrenes Aniline and substituted anilines Aryl ketones Dialkylarylamines Benzoyl derivatives Alkylarylthioethers Acryloyl compounds Enones Sulfenyl compounds Oxacyclic compounds Dialkyl ethers Azacyclic compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Retrochalcone - Cinnamic acid or derivatives - Phenylmorpholine - Tertiary aliphatic/aromatic amine - Aryl thioether - Styrene - Benzoyl - Thiophenol ether - Aniline or substituted anilines - Dialkylarylamine - Aryl ketone - Alkylarylthioether - Monocyclic benzene moiety - Morpholine - Oxazinane - Benzenoid - Enone - Acryloyl-group - Alpha,beta-unsaturated ketone - Ketone - Tertiary amine - Sulfenyl compound - Organoheterocyclic compound - Azacycle - Ether - Oxacycle - Dialkyl ether - Thioether - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Amine - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as retrochalcones. These are a form of normal chalcones that are structurally distinguished by the lack of oxygen functionalities at the C2'- and C6'-positions.
External Descriptors
Not available