Structure Information
Structure

Compound Identification

SMILES

CC(C)NC1=NC=C(C=N1)C1=CC=C(C=C1)[C@@](C)(C1CC1)C1=NOC(=N1)C1=CN(CC(=O)N(C)C)N=C1

InChIKey

InChIKey=KXQKCPIYJPBSDQ-MHZLTWQESA-N

Formula

C27H32N8O2

Mass

500.607

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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

5-phenylpyrimidine - Aminopyrimidine - Secondary aliphatic/aromatic amine - Monocyclic benzene moiety - Benzenoid - Heteroaromatic compound - Azole - Tertiary carboxylic acid amide - 1,2,4-oxadiazole - Pyrazole - Oxadiazole - Amino acid or derivatives - Tertiary amine - Carboxamide group - Oxacycle - Azacycle - Secondary amine - Carboxylic acid derivative - Organic oxide - Carbonyl group - Hydrocarbon derivative - Amine - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Organic oxygen 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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