Structure Information
Structure

Compound Identification

SMILES

CNC1=C(C=C(C=C2C(=O)N(C)C(=O)N(C)C2=O)C=C1)[N+]([O-])=O

InChIKey

InChIKey=WANDXFBNFXAVSA-UHFFFAOYSA-N

Formula

C14H14N4O5

Mass

318.289

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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 - Nitrobenzene - Nitroaromatic compound - Phenylalkylamine - Aniline or substituted anilines - N-acyl urea - Secondary aliphatic/aromatic amine - Ureide - Monocyclic benzene moiety - 1,3-diazinane - Benzenoid - Dicarboximide - Organic nitro compound - Urea - Amino acid or derivatives - Carbonic acid derivative - C-nitro compound - Allyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Secondary amine - Azacycle - Carboxylic acid derivative - Organic oxoazanium - Organic zwitterion - Hydrocarbon derivative - Organic oxide - Amine - Organopnictogen compound - Organonitrogen compound - Carbonyl group - Organic oxygen compound - Organic nitrogen compound - Organooxygen 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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