Structure Information
Structure

Compound Identification

SMILES

CCOC(=O)C(=C\C=C1/C=CNC2=NCCN12)\C#N

InChIKey

InChIKey=KYCCQEPHQYGGBL-HULALXFYSA-N

Formula

C13H14N4O2

Mass

258.281

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Imidazopyrimidines

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Imidazopyrimidines

Alternative Parents

Molecular Framework

Aliphatic heteropolycyclic compounds

Substituents

Imidazopyrimidine - Fatty acid ester - Hydropyrimidine - 1,2,3,4-tetrahydropyrimidine - Fatty acyl - 2-imidazoline - Enoate ester - Alpha,beta-unsaturated carboxylic ester - Carboxylic acid ester - Guanidine - Azacycle - Enamine - Carboxylic acid derivative - Organic 1,3-dipolar compound - Monocarboxylic acid or derivatives - Carbonitrile - Nitrile - Carboximidamide - Propargyl-type 1,3-dipolar organic compound - Organopnictogen compound - Organic oxygen compound - Organic oxide - Organic nitrogen compound - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Carbonyl group - Aliphatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as imidazopyrimidines. These are organic polycyclic compounds containing an imidazole ring fused to a pyrimidine ring. Imidazole is 5-membered ring consisting of three carbon atoms, and two nitrogen centers at the 1- and 3-positions. Pyrimidine is a 6-membered ring consisting of four carbon atoms and two nitrogen centers at the 1- and 3- ring positions.

External Descriptors

Not available

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