Structure Information
Structure

Compound Identification

SMILES

CCCCCCCCCCCCCCCCCC(=O)NC(NC(=S)NC1=CC=C(I)C=C1)C(Cl)(Cl)Cl

InChIKey

InChIKey=MTSGPDRGWMSLQD-UHFFFAOYSA-N

Formula

C27H43Cl3IN3OS

Mass

690.98

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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-phenylthioureas

Alternative Parents

Molecular Framework

Aromatic homomonocyclic compounds

Substituents

N-phenylthiourea - Halobenzene - Iodobenzene - Aryl halide - Aryl iodide - Fatty amide - Fatty acyl - N-acyl-amine - Carboxamide group - Thiourea - Secondary carboxylic acid amide - Carboxylic acid derivative - Organoiodide - Organochloride - Organohalogen compound - Alkyl halide - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Alkyl chloride - Carbonyl group - Organic oxygen compound - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Aromatic homomonocyclic compound

Description

This compound belongs to the class of organic compounds known as n-phenylthioureas. These are compounds containing a N-phenylthiourea moiety, which is structurally characterized by a phenyl group linked to one nitrogen atom of a thiourea group.

External Descriptors

Not available

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