Structure Information
Structure

Compound Identification

SMILES

CC(=O)NCCC1=CC=C(C=C1)C(=O)CSC1=NC=C(C#N)C(N)=N1

InChIKey

InChIKey=IAIPDSHGMLBDFI-UHFFFAOYSA-N

Formula

C17H17N5O2S

Mass

355.42

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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 - N-acetyl-2-arylethylamine - Aryl thioether - Benzoyl - Aryl alkyl ketone - Aminopyrimidine - Alkylarylthioether - Monocyclic benzene moiety - Pyrimidine - Imidolactam - Benzenoid - Heteroaromatic compound - Acetamide - Amino acid or derivatives - Carboxamide group - Secondary carboxylic acid amide - Azacycle - Carboxylic acid derivative - Carbonitrile - Nitrile - Organoheterocyclic compound - Sulfenyl compound - Thioether - Cyanide - Organic nitrogen compound - Organonitrogen compound - Organosulfur compound - Primary amine - Organic oxide - Hydrocarbon derivative - Amine - 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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