Structure Information
Structure

Compound Identification

SMILES

NC1=NC(=CC(NNC(=O)C2=CC=CO2)=N1)C1=CC(=CC=C1)N1CCCCC1

InChIKey

InChIKey=BRXAVOBBHXMUAR-UHFFFAOYSA-N

Formula

C20H22N6O2

Mass

378.436

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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

Phenylpyrimidines

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Phenylpiperidine - 4-phenylpyrimidine - Furoic acid or derivatives - Tertiary aliphatic/aromatic amine - Aniline or substituted anilines - Dialkylarylamine - Aminopyrimidine - Monocyclic benzene moiety - Piperidine - Benzenoid - Imidolactam - Furan - Heteroaromatic compound - Amino acid or derivatives - Carboxylic acid hydrazide - Tertiary amine - Oxacycle - Carboxylic acid derivative - Azacycle - Primary amine - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organonitrogen compound - Amine - Organic oxygen compound - Organic nitrogen compound - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as phenylpyrimidines. These are polycyclic aromatic compounds containing a benzene ring linked to a pyrimidine ring through a CC or CN bond. 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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