Structure Information
Structure

Compound Identification

SMILES

Cl.COC1=CC=C(C=C1)C(=O)CCSC(CCO)=C(C)N(CC1=CN=C(C)N=C1N)C=O

InChIKey

InChIKey=SBMHSEJILCTAHF-UHFFFAOYSA-N

Formula

C22H29ClN4O4S

Mass

481.01

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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 - Phenoxy compound - Anisole - Benzoyl - Phenol ether - Methoxybenzene - Aryl alkyl ketone - Alkyl aryl ether - Aminopyrimidine - Monocyclic benzene moiety - Pyrimidine - Benzenoid - Imidolactam - Tertiary carboxylic acid amide - Heteroaromatic compound - Thioenolether - Amino acid or derivatives - Carboxamide group - Sulfenyl compound - Organoheterocyclic compound - Azacycle - Carboxylic acid derivative - Ether - Organic nitrogen compound - Organonitrogen compound - Organosulfur compound - Primary alcohol - Alcohol - Hydrocarbon derivative - Organic oxide - Amine - Hydrochloride - Primary 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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