Structure Information
Structure

Compound Identification

SMILES

ClC1=CC=CC(C2=CC=C(O2)C=CC(=O)NC(=S)NC2=CC(Cl)=C(C=C2)N2CCCCC2)=C1Cl

InChIKey

InChIKey=XRMSMLODDIZTAY-UHFFFAOYSA-N

Formula

C25H22Cl3N3O2S

Mass

534.88

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

N-phenylthioureas

Intermediate Tree Nodes

Not available

Direct Parent

N-acyl-phenylthioureas

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

N-acyl-phenylthiourea - Phenylpiperidine - 1,2-dichlorobenzene - Tertiary aliphatic/aromatic amine - Dialkylarylamine - Aniline or substituted anilines - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Piperidine - Heteroaromatic compound - Furan - Thiourea - Tertiary amine - Amino acid or derivatives - Azacycle - Oxacycle - Carboxylic acid derivative - Organoheterocyclic compound - Organic nitrogen compound - Organosulfur compound - Organic oxygen compound - Amine - Hydrocarbon derivative - Organic oxide - Carbonyl group - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as n-acyl-phenylthioureas. These are thiourea derivatives where one nitrogen atom of the urea group is linked to a phenyl group and the other is acylated.

External Descriptors

Not available

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