Structure Information
Structure

Compound Identification

SMILES

CN1CCN(CC1)C1=CC=CC=C1NC(=S)NC(=O)C1=C(Cl)C=CC(Br)=C1

InChIKey

InChIKey=QQFIZRSNQGAMLF-UHFFFAOYSA-N

Formula

C19H20BrClN4OS

Mass

467.81

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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 - 2-halobenzoic acid or derivatives - 3-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Benzoic acid or derivatives - Benzoyl - Tertiary aliphatic/aromatic amine - Aniline or substituted anilines - Dialkylarylamine - Bromobenzene - Chlorobenzene - Halobenzene - N-alkylpiperazine - N-methylpiperazine - Piperazine - Aryl chloride - Aryl bromide - Aryl halide - 1,4-diazinane - Vinylogous halide - Thiourea - Tertiary amine - Tertiary aliphatic amine - Amino acid or derivatives - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Hydrocarbon derivative - Organic oxide - Organohalogen compound - Amine - Organic oxygen compound - Organic nitrogen compound - Organobromide - Organochloride - 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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