Structure Information
Structure

Compound Identification

SMILES

CN1C(=O)N(C)C2(N=C3SC(=CC4=CC5=C(OCO5)C=C4Br)C(=O)N3NC12C1=CC=CC=C1)C1=CC=CC=C1

InChIKey

InChIKey=LQIIWGUYJZZPTB-UHFFFAOYSA-N

Formula

C28H22BrN5O4S

Mass

604.48

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Phenylpropanoids and polyketides

Class

Stilbenes

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Stilbenes

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Stilbene - Phenylimidazolidine - Benzodioxole - Amino-1,2,4-triazine - Secondary aliphatic/aromatic amine - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Imidazolidinone - Triazine - Benzenoid - 1,2,4-triazine - Heteroaromatic compound - Thiazole - Azole - Imidazolidine - Urea - Lactam - Oxacycle - Azacycle - Organoheterocyclic compound - Acetal - Organopnictogen compound - Carbonyl group - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organic nitrogen compound - Organooxygen compound - Organohalogen compound - Organobromide - Organonitrogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as stilbenes. These are organic compounds containing a 1,2-diphenylethylene moiety. Stilbenes (C6-C2-C6 ) are derived from the common phenylpropene (C6-C3) skeleton building block. The introduction of one or more hydroxyl groups to a phenyl ring lead to stilbenoids.

External Descriptors

Not available

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