Structure Information
Structure

Compound Identification

SMILES

CC[C@@H](C)C1=CC=C(C=C1)C(=O)COC(=O)C1=C(NC(C)=O)SC(C)=C1C

InChIKey

InChIKey=NIBBBCQYHHWZPF-GFCCVEGCSA-N

Formula

C21H25NO4S

Mass

387.49

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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

Alkyl-phenylketones

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Alkyl-phenylketone - P-cymene - Aromatic monoterpenoid - Monocyclic monoterpenoid - Monoterpenoid - N-acetylarylamine - Phenylpropane - Benzoyl - Thiophene carboxylic acid or derivatives - Aryl alkyl ketone - N-arylamide - Monocyclic benzene moiety - Benzenoid - Vinylogous amide - Acetamide - Heteroaromatic compound - Thiophene - Secondary carboxylic acid amide - Carboxamide group - Carboxylic acid ester - Organoheterocyclic compound - Carboxylic acid derivative - Hydrocarbon derivative - Organic oxide - Organonitrogen compound - Organic nitrogen 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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