Structure Information
Structure

Compound Identification

SMILES

CN1C(=O)CC(C)(N=C1N)C1=CC(CC(=O)C2=CN=C(OCCF)C=N2)=CC=C1

InChIKey

InChIKey=ZFDLPRKBSFQXBX-UHFFFAOYSA-N

Formula

C20H22FN5O3

Mass

399.426

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organic oxygen compounds

Class

Organooxygen compounds

Subclass

Carbonyl compounds

Intermediate Tree Nodes

Ketones - Aryl ketones

Direct Parent

Aryl alkyl ketones

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Aryl alkyl ketone - Alkyl aryl ether - Monocyclic benzene moiety - Hydropyrimidine - 1,4,5,6-tetrahydropyrimidine - Pyrazine - Benzenoid - Heteroaromatic compound - Amino acid or derivatives - Guanidine - Tertiary amine - Carboxylic acid derivative - Ether - Azacycle - Organoheterocyclic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Carboximidamide - Alkyl halide - Alkyl fluoride - Organic nitrogen compound - Amine - Organic oxide - Organohalogen compound - Organofluoride - Organonitrogen compound - Hydrocarbon derivative - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as aryl alkyl ketones. These are ketones have the generic structure RC(=O)R', where R = aryl group and R'=alkyl group.

External Descriptors

Not available

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