Structure Information
Structure

Compound Identification

SMILES

O=C(C1C(N(C(=O)C1=O)C1=NC=CC=N1)C1=CC=CS1)C1=CC=CO1

InChIKey

InChIKey=CXKAPGDWEKFEIL-UHFFFAOYSA-N

Formula

C17H11N3O4S

Mass

353.35

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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 - 1,3-diketone - Pyrimidine - Pyrrolidone - 2-pyrrolidone - 3-pyrrolidone - 1,3-dicarbonyl compound - Furan - Pyrrolidine - Heteroaromatic compound - Tertiary carboxylic acid amide - Thiophene - Carboxamide group - Lactam - Cyclic ketone - Carboxylic acid derivative - Oxacycle - Azacycle - Organoheterocyclic compound - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Organonitrogen compound - 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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