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Structure Information
Structure

Compound Identification

SMILES

CC(=NCC1=CC=CC=C1)C1C(=O)NC(=O)NC1=O

InChIKey

InChIKey=QRXVHJKPOQWWAJ-UHFFFAOYSA-N

Formula

C13H13N3O3

Mass

259.265

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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

Barbiturate - Ureide - Monocyclic benzene moiety - 1,3-diazinane - 1,3-dicarbonyl compound - Benzenoid - Azomethine - Dicarboximide - Secondary ketimine - Urea - Ketimine - Carboxylic acid derivative - Azacycle - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Imine - Organopnictogen compound - Carbonyl group - 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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