Structure Information
Structure

Compound Identification

SMILES

CN1CCN(CC1)C(=O)C1=C(N=C(S1)C1=CC=CC=C1)C(=O)C1=CC(=CC=C1)[N+]([O-])=O

InChIKey

InChIKey=BXLJDOTUHLAWIY-UHFFFAOYSA-N

Formula

C22H20N4O4S

Mass

436.49

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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

Aryl-phenylketones

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Aryl-phenylketone - Nitrobenzene - 2-heteroaryl carboxamide - 2,4,5-trisubstituted 1,3-thiazole - Nitroaromatic compound - Benzoyl - Thiazolecarboxamide - Thiazolecarboxylic acid or derivatives - N-methylpiperazine - N-alkylpiperazine - Monocyclic benzene moiety - 1,4-diazinane - Piperazine - Benzenoid - Azole - Heteroaromatic compound - Tertiary carboxylic acid amide - Thiazole - Carboxamide group - C-nitro compound - Organic nitro compound - Tertiary amine - Amino acid or derivatives - Tertiary aliphatic amine - Propargyl-type 1,3-dipolar organic compound - Organic oxoazanium - Azacycle - Carboxylic acid derivative - Allyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organoheterocyclic compound - Organonitrogen compound - Amine - Hydrocarbon derivative - Organic nitrogen compound - Organic salt - Organic oxide - Organic cation - Aromatic heteromonocyclic compound

Description

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

External Descriptors

Not available

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