Structure Information
Structure

Compound Identification

SMILES

FC1=CC=CC=C1C1N2NC=NC2=NC2=C1C(OC1=C2C=C(Cl)C=C1)C1=CC(Br)=CC=C1

InChIKey

InChIKey=YMHQTGKBCNDSEK-UHFFFAOYSA-N

Formula

C24H15BrClFN4O

Mass

509.76

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Phenylpropanoids and polyketides

Class

Flavonoids

Subclass

Flav-3-enes

Intermediate Tree Nodes

Not available

Direct Parent

Flav-3-enes

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Flav-3-ene - 1-benzopyran - Benzopyran - Bromobenzene - Fluorobenzene - Alkyl aryl ether - Halobenzene - Aryl chloride - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Hydropyrimidine - Benzenoid - 1,6-dihydropyrimidine - Aryl bromide - Triazoline - Carboxylic acid amidrazone - Amidine - Formamidine - Oxacycle - Azacycle - Organoheterocyclic compound - Organic 1,3-dipolar compound - Ether - Propargyl-type 1,3-dipolar organic compound - Hydrocarbon derivative - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Organofluoride - Imine - Organohalogen compound - Organobromide - Organochloride - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as flav-3-enes. These are flavonoids with a structure based on the 2-phenylchromene skeleton, with a double bond between the C3 and C4 carbon atoms of the chromene moiety.

External Descriptors

Not available

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