Structure Information
Structure

Compound Identification

SMILES

CC(=O)C1=CC=C(C=C1)N1CCN(CC1)C1=NN=NC2=C1SC1=C2C=C(C#N)C(=N1)N1CCN(CC2=CC=CC=C2)CC1

InChIKey

InChIKey=FMFMLURHLVAKIT-UHFFFAOYSA-N

Formula

C32H31N9OS

Mass

589.72

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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 heteropolycyclic compounds

Substituents

Alkyl-phenylketone - Pyridinylpiperazine - Phenylpiperazine - N-arylpiperazine - Acetophenone - Thienopyridine - Tertiary aliphatic/aromatic amine - Phenylmethylamine - Benzoyl - Aryl alkyl ketone - Dialkylarylamine - Aniline or substituted anilines - Benzylamine - N-alkylpiperazine - Aralkylamine - Amino-1,2,3-triazine - Aminopyridine - Piperazine - Benzenoid - Pyridine - Triazine - Imidolactam - 1,4-diazinane - Monocyclic benzene moiety - 1,2,3-triazine - Heteroaromatic compound - Thiophene - Tertiary aliphatic amine - Tertiary amine - Nitrile - Carbonitrile - Organoheterocyclic compound - Azacycle - Organonitrogen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Cyanide - Amine - Aromatic heteropolycyclic 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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