Structure Information
Structure

Compound Identification

SMILES

CC1CCN(CC1)C1=CC=CC=C1NC(=S)NC(=O)C1=C(Cl)C=CC(I)=C1

InChIKey

InChIKey=RGIKMURKOIPRRO-UHFFFAOYSA-N

Formula

C20H21ClIN3OS

Mass

513.82

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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 - 2-halobenzoic acid or derivatives - 3-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Benzoic acid or derivatives - Tertiary aliphatic/aromatic amine - Benzoyl - Dialkylarylamine - Aniline or substituted anilines - Chlorobenzene - Iodobenzene - Halobenzene - Piperidine - Aryl iodide - Aryl chloride - Aryl halide - Vinylogous halide - Tertiary amine - Amino acid or derivatives - Thiourea - Carboxylic acid derivative - Azacycle - Organoheterocyclic compound - Organosulfur compound - Organohalogen compound - Amine - Organochloride - Organoiodide - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organic nitrogen 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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