Structure Information
Structure

Compound Identification

SMILES

IC1=CC=CC(=C1)C(=O)NC(=S)NC1=CC=C(C=C1)N1CCN(CC2=CC=CC=C2)CC1

InChIKey

InChIKey=AOOJDOJRRDHCAW-UHFFFAOYSA-N

Formula

C25H25IN4OS

Mass

556.47

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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 - 3-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Benzoic acid or derivatives - Benzoyl - Benzylamine - Aniline or substituted anilines - Dialkylarylamine - Phenylmethylamine - Tertiary aliphatic/aromatic amine - Halobenzene - Iodobenzene - Aralkylamine - N-alkylpiperazine - Piperazine - Aryl halide - Aryl iodide - 1,4-diazinane - Tertiary amine - Amino acid or derivatives - Tertiary aliphatic amine - Thiourea - Organoheterocyclic compound - Azacycle - Carboxylic acid derivative - Amine - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Organohalogen compound - Organoiodide - Hydrocarbon derivative - Organic oxide - Organonitrogen compound - Organooxygen compound - Organosulfur 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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