Structure Information
Structure

Compound Identification

SMILES

CC1=CC(NC2=NC(\C=C\C3=CC=CC=C3)=NC(=C2)C(=O)OC2CCNCC2)=NN1

InChIKey

InChIKey=VGZSSDPFNXNJGX-BQYQJAHWSA-N

Formula

C22H24N6O2

Mass

404.474

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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

Pyrimidine-6-carboxylic acid - Styrene - Aminopyrimidine - Monocyclic benzene moiety - Imidolactam - Benzenoid - Piperidine - Azole - Heteroaromatic compound - Pyrazole - Amino acid or derivatives - Carboxylic acid ester - Carboxylic acid derivative - Azacycle - Secondary aliphatic amine - Secondary amine - Organic nitrogen compound - Amine - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organonitrogen compound - Organooxygen 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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