Structure Information
Structure

Compound Identification

SMILES

O=C(CSC1=NN=NN1C[C@H]1CCCO1)C1=CC=C(C=C1)N1CCCC1=O

InChIKey

InChIKey=PPFLUXGWXMOGGX-OAHLLOKOSA-N

Formula

C18H21N5O3S

Mass

387.46

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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 - 1-phenylpyrrolidine - Aryl thioether - Benzoyl - Aryl alkyl ketone - Alkylarylthioether - 2-pyrrolidone - Monocyclic benzene moiety - Pyrrolidone - Benzenoid - Pyrrole - Oxolane - Pyrrolidine - Heteroaromatic compound - Tetrazole - Tertiary carboxylic acid amide - Azole - Carboxamide group - Lactam - Organoheterocyclic compound - Azacycle - Oxacycle - Ether - Dialkyl ether - Carboxylic acid derivative - Sulfenyl compound - Thioether - Organosulfur compound - Organonitrogen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - 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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