Compound Identification
SMILES
CCOC12SN(N=C1C1=CC=CC=C1OC2(OCC)C1=CC=C(Cl)C=C1)C1=C(Cl)C=C(NC(C)=O)C=C1
InChIKey
InChIKey=LBKYNVVJTQGUIJ-UHFFFAOYSA-N
Formula
C27H25Cl2N3O4S
Mass
558.47
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
-
Class
Flavonoids
- Subclass Flavans
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Class
Flavonoids
-
Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Flavonoids
Subclass
Flavans
Intermediate Tree Nodes
Not available
Direct Parent
Flavans
Alternative Parents
M-haloacetanilides 1-benzopyrans Benzylethers N-acetylarylamines Chlorobenzenes Ketals Aryl chlorides Acetamides Secondary carboxylic acid amides Oxacyclic compounds Azacyclic compounds Organopnictogen compounds Hydrocarbon derivatives Carbonyl compounds Organochlorides Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Flavan - M-haloacetanilide - Haloacetanilide - Acetanilide - Benzopyran - Chromane - 1-benzopyran - Benzylether - N-acetylarylamine - Anilide - N-arylamide - Chlorobenzene - Halobenzene - Ketal - Benzenoid - Monocyclic benzene moiety - Aryl halide - Aryl chloride - Acetamide - Secondary carboxylic acid amide - Carboxamide group - Oxacycle - Acetal - Carboxylic acid derivative - Organoheterocyclic compound - Azacycle - Organic nitrogen compound - Organohalogen compound - Carbonyl group - Organochloride - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as flavans. These are compounds containing a flavan moiety, with a structure characterized by a 2-phenyl-3,4-dihydro-2H-1-benzopyran skeleton.
External Descriptors
Not available