Structure Information
Structure

Compound Identification

SMILES

Cl.COC1=CC(CC2=CN=C(N)N=C2N)=CC(OC)=C1C(=O)CS(C)(=O)=O

InChIKey

InChIKey=ODPWYMWPLDBGCJ-UHFFFAOYSA-N

Formula

C16H21ClN4O5S

Mass

416.88

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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 - M-dimethoxybenzene - Dimethoxybenzene - Phenoxy compound - Anisole - Benzoyl - Phenol ether - Methoxybenzene - Aryl alkyl ketone - Alkyl aryl ether - Aminopyrimidine - Monocyclic benzene moiety - Pyrimidine - Benzenoid - Imidolactam - Sulfonyl - Sulfone - Heteroaromatic compound - Azacycle - Ether - Organoheterocyclic compound - Amine - Primary amine - Organosulfur compound - Organonitrogen compound - Organic nitrogen compound - Organic oxide - Hydrochloride - Hydrocarbon derivative - 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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