Structure Information
Structure

Compound Identification

SMILES

OC(=O)C(F)(F)F.CC1=C(C(=O)N(C[C@H](N)C2=CC=CC=C2)C(=O)N1CC1=CC=CC=C1Br)C1=CC=CC=C1F

InChIKey

InChIKey=LNKGRZREPFRNLV-BQAIUKQQSA-N

Formula

C28H24BrF4N3O4

Mass

622.415

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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

Not available

Substituents

5-phenylpyrimidine - Aralkylamine - Pyrimidone - Bromobenzene - Fluorobenzene - Halobenzene - Aryl bromide - Aryl fluoride - Aryl halide - Benzenoid - Monocyclic benzene moiety - Hydropyrimidine - Alpha-halocarboxylic acid - Alpha-halocarboxylic acid or derivatives - Heteroaromatic compound - Vinylogous amide - Urea - Lactam - Monocarboxylic acid or derivatives - Azacycle - Carboxylic acid derivative - Carboxylic acid - Organobromide - Organonitrogen compound - Organooxygen compound - Organofluoride - Alkyl halide - Carbonyl group - Primary amine - Alkyl fluoride - Primary aliphatic amine - Hydrocarbon derivative - Organic oxide - Amine - Organic oxygen compound - Organic nitrogen compound - Organohalogen 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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