Structure Information
Structure

Compound Identification

SMILES

OC(=O)C1=CC(COC2=C(Br)C=C(C=C3C(=O)NC(=O)N(C4CCCCC4)C3=O)C=C2)=CC=C1

InChIKey

InChIKey=JJNPAUDSUWGDFG-UHFFFAOYSA-N

Formula

C25H23BrN2O6

Mass

527.371

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Diazines

Subclass

Pyrimidines and pyrimidine derivatives

Intermediate Tree Nodes

Pyrimidones

Direct Parent

Barbituric acid derivatives

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Benzoic acid - Barbiturate - Benzoic acid or derivatives - Benzoyl - Phenoxy compound - Phenol ether - N-acyl urea - Halobenzene - Bromobenzene - Alkyl aryl ether - Ureide - 1,3-diazinane - Aryl bromide - Aryl halide - Benzenoid - Monocyclic benzene moiety - Dicarboximide - Urea - Carbonic acid derivative - Ether - Carboxylic acid - Carboxylic acid derivative - Azacycle - Monocarboxylic acid or derivatives - Organohalogen compound - Organobromide - Carbonyl group - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as barbituric acid derivatives. These are compounds containing a perhydropyrimidine ring substituted at C-2, -4 and -6 by oxo groups.

External Descriptors

Not available

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