Structure Information
Structure

Compound Identification

SMILES

CCCCC1=NC(C)=C(C(=O)OC)C(=O)N1CC1=CC=C(OC(C2=NNN=N2)C2=CC=CC=C2Cl)C=C1

InChIKey

InChIKey=HFKJBGFROAEKGH-UHFFFAOYSA-N

Formula

C26H27ClN6O4

Mass

522.99

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Diazines

Subclass

Pyrimidines and pyrimidine derivatives

Intermediate Tree Nodes

Pyrimidinecarboxylic acids and derivatives

Direct Parent

Pyrimidinecarboxylic acids

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Hydropyrimidine carboxylic acid derivative - Pyrimidine-5-carboxylic acid - Phenoxy compound - Phenol ether - Alkyl aryl ether - Chlorobenzene - Halobenzene - Pyrimidone - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Hydropyrimidine - Azole - Heteroaromatic compound - Vinylogous amide - Methyl ester - Tetrazole - Lactam - Carboxylic acid ester - Azacycle - Ether - Carboxylic acid derivative - Organic oxide - Organic oxygen compound - Hydrocarbon derivative - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as pyrimidinecarboxylic acids. These are pyrimidines with a structure containing a carboxyl group attached to the pyrimidine ring.

External Descriptors

Not available

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