Structure Information
Structure

Compound Identification

SMILES

COC1=C(Cl)C=C(C=C1)N1C(=O)NC(=O)C(=CC2=CC=CN2CC2=CC=CC=C2F)C1=O

InChIKey

InChIKey=HWHYGQIJKOFOHO-UHFFFAOYSA-N

Formula

C23H17ClFN3O4

Mass

453.85

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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

Methoxyaniline - Barbiturate - Phenol ether - Phenoxy compound - Anisole - Methoxybenzene - Halobenzene - N-acyl urea - Fluorobenzene - Chlorobenzene - Alkyl aryl ether - Ureide - Substituted pyrrole - Monocyclic benzene moiety - 1,3-diazinane - Benzenoid - Aryl chloride - Aryl fluoride - Aryl halide - Pyrrole - Dicarboximide - Heteroaromatic compound - Urea - Carbonic acid derivative - Azacycle - Carboxylic acid derivative - Ether - Organofluoride - Organonitrogen compound - Organic oxygen compound - Carbonyl group - Organooxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organochloride - Organohalogen 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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