Structure Information
Structure

Compound Identification

SMILES

COC1=CC=CC=C1C(=O)NC(=S)NC1=CC(Cl)=C(C=C1)N1CCN(CC1)C(=O)C(C)C

InChIKey

InChIKey=KXTBNAQLKCLLHM-UHFFFAOYSA-N

Formula

C23H27ClN4O3S

Mass

475.0

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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 - N-arylpiperazine - Phenylpiperazine - Benzoic acid or derivatives - Phenoxy compound - Anisole - Methoxybenzene - Aniline or substituted anilines - Dialkylarylamine - Benzoyl - Phenol ether - Tertiary aliphatic/aromatic amine - Alkyl aryl ether - Halobenzene - Chlorobenzene - Aryl chloride - 1,4-diazinane - Aryl halide - Piperazine - Tertiary carboxylic acid amide - Carboxamide group - Thiourea - Tertiary amine - Amino acid or derivatives - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Ether - Organic oxygen compound - Organooxygen compound - Carbonyl group - Organosulfur compound - Amine - Organic nitrogen compound - Hydrocarbon derivative - Organonitrogen compound - Organochloride - Organic oxide - Organohalogen 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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