Structure Information
Structure

Compound Identification

SMILES

FC1=CC=C(C=C1)C(=O)CN1CCC(CN2C(=O)SC3=C2C=C(Cl)C=C3)CC1

InChIKey

InChIKey=NXXSIBKQLDTNMY-UHFFFAOYSA-N

Formula

C21H20ClFN2O2S

Mass

418.91

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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 heteropolycyclic compounds

Substituents

Alkyl-phenylketone - 1,3-benzothiazole - Benzoyl - Aryl alkyl ketone - Fluorobenzene - Halobenzene - Aryl chloride - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Piperidine - Benzenoid - Thiazole - Heteroaromatic compound - Azole - Alpha-aminoketone - Tertiary aliphatic amine - Tertiary amine - Organoheterocyclic compound - Azacycle - Amine - Organic nitrogen compound - Organic oxide - Hydrocarbon derivative - Organohalogen compound - Organochloride - Organofluoride - Organonitrogen compound - Aromatic heteropolycyclic 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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