Structure Information
Structure

Compound Identification

SMILES

FC(F)(F)C1=C(NC(=O)CC2=C(C3=CC=CC=C3)C3=CC(CN4CCN(CC4)C4=CC=CC=C4)=C(Cl)C=C3OC2=O)C=CC(Cl)=C1

InChIKey

InChIKey=YSWSIRICADVKHR-UHFFFAOYSA-N

Formula

C35H28Cl2F3N3O3

Mass

666.52

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Phenylpropanoids and polyketides

Class

Neoflavonoids

Subclass

Neoflavones

Intermediate Tree Nodes

Not available

Direct Parent

Neoflavones

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

4-phenylcoumarin - N-arylpiperazine - Phenylpiperazine - Coumarin - Benzopyran - Trifluoromethylbenzene - 1-benzopyran - Anilide - N-arylamide - Tertiary aliphatic/aromatic amine - Dialkylarylamine - Aniline or substituted anilines - Chlorobenzene - Aralkylamine - Halobenzene - N-alkylpiperazine - Pyranone - Aryl chloride - Aryl halide - Monocyclic benzene moiety - 1,4-diazinane - Piperazine - Pyran - Benzenoid - Heteroaromatic compound - Tertiary aliphatic amine - Tertiary amine - Secondary carboxylic acid amide - Carboxamide group - Lactone - Amino acid or derivatives - Oxacycle - Organoheterocyclic compound - Azacycle - Carboxylic acid derivative - Alkyl halide - Organic oxide - Organic oxygen compound - Hydrocarbon derivative - Organohalogen compound - Carbonyl group - Organic nitrogen compound - Amine - Organochloride - Alkyl fluoride - Organofluoride - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as neoflavones. These are neoflavonoids with a structure based on the 4-phenylcoumarin skeleton.

External Descriptors

Not available

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