Structure Information
Structure

Compound Identification

SMILES

CCC(=O)N1CCN(CC1)C1=C(NC(=S)NC(=O)C2=CC=C(OCC(C)C)C=C2)C=C(Cl)C=C1

InChIKey

InChIKey=WVWHEYMAJWLEJB-UHFFFAOYSA-N

Formula

C25H31ClN4O3S

Mass

503.06

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