Structure Information
Structure

Compound Identification

SMILES

NC1=NC(=C(S1)[C@@H]1CCN(CCCC(=O)C2=CC=C(F)C=C2)C1)C1=CC=C(F)C=C1

InChIKey

InChIKey=PMIAIKWRXUGRQG-QGZVFWFLSA-N

Formula

C23H23F2N3OS

Mass

427.51

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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 - Phenylketones

Direct Parent

Alkyl-phenylketones

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Alkyl-phenylketone - Butyrophenone - Phenylbutylamine - 2,4,5-trisubstituted 1,3-thiazole - Benzoyl - Aryl alkyl ketone - Halobenzene - Fluorobenzene - Aralkylamine - Aryl fluoride - Gamma-aminoketone - Aryl halide - 1,3-thiazol-2-amine - N-alkylpyrrolidine - Benzenoid - Monocyclic benzene moiety - Thiazole - Azole - Heteroaromatic compound - Pyrrolidine - Tertiary amine - Tertiary aliphatic amine - Azacycle - Organoheterocyclic compound - Organonitrogen compound - Primary amine - Amine - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organofluoride - Organohalogen compound - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as alkyl-phenylketones. These are aromatic compounds containing a ketone substituted by one alkyl group, and a phenyl group.

External Descriptors

Not available

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