Structure Information
Structure

Compound Identification

SMILES

OC(=O)\C=C/C(O)=O.CC1=CN=C(CCCOC2=CC=CC(NC(N)=NCC(F)(F)F)=N2)NC1=O

InChIKey

InChIKey=MIBXGXQQSNIVFF-BTJKTKAUSA-N

Formula

C20H23F3N6O6

Mass

500.435

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Diazines

Subclass

Pyrimidines and pyrimidine derivatives

Intermediate Tree Nodes

Not available

Direct Parent

Pyrimidones

Alternative Parents

Molecular Framework

Not available

Substituents

Alkyl aryl ether - Pyrimidone - Dicarboxylic acid or derivatives - Hydropyrimidine - Pyridine - Unsaturated fatty acid - Imidolactam - Fatty acid - Fatty acyl - Heteroaromatic compound - Guanidine - Lactam - Organic 1,3-dipolar compound - Azacycle - Carboxylic acid - Carboxylic acid derivative - Ether - Propargyl-type 1,3-dipolar organic compound - Carboximidamide - Carbonyl group - Alkyl fluoride - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Alkyl halide - Organic oxygen compound - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as pyrimidones. These are compounds that contain a pyrimidine ring, which bears a ketone. 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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