Structure Information
Structure

Compound Identification

SMILES

CNC(=O)C1=C(OC2=CC(N(C)S(C)(=O)=O)=C(C=C12)C1=CC(OC)=NC(=N1)C1=CC2=CC=CC=C2N1)C1=CC=C(F)C=C1

InChIKey

InChIKey=BHTQDRBNSZEBML-UHFFFAOYSA-N

Formula

C31H26FN5O5S

Mass

599.64

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Phenylpropanoids and polyketides

Class

2-arylbenzofuran flavonoids

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

2-arylbenzofuran flavonoids

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

2-arylbenzofuran flavonoid - Neolignan skeleton - 2-phenylbenzofuran - Phenylbenzofuran - Sulfanilide - Benzofuran - Indole - Indole or derivatives - Furoic acid or derivatives - Furan-3-carboxylic acid or derivatives - Alkyl aryl ether - Fluorobenzene - Halobenzene - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Pyrimidine - Substituted pyrrole - Organic sulfonic acid amide - Organosulfonic acid amide - Pyrrole - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Aminosulfonyl compound - Heteroaromatic compound - Furan - Carboxamide group - Secondary carboxylic acid amide - Carboxylic acid derivative - Organoheterocyclic compound - Azacycle - Oxacycle - Ether - Organic oxygen compound - Hydrocarbon derivative - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Organic oxide - Organosulfur compound - Organic nitrogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as 2-arylbenzofuran flavonoids. These are phenylpropanoids containing the 2-phenylbenzofuran moiety.

External Descriptors

Not available

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