Structure Information
Structure

Compound Identification

SMILES

ClC1=CC=CC=C1N1C(=O)C(=NNC2=CC=C(Br)C=C2)C(=O)N(C2=CC=CC=C2)C1=S

InChIKey

InChIKey=HJZFGTXPEURPHD-UHFFFAOYSA-N

Formula

C22H14BrClN4O2S

Mass

513.79

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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 heteromonocyclic compounds

Substituents

N-phenylthiourea - Thiobarbiturate - Phenylhydrazine - Bromobenzene - Chlorobenzene - Halobenzene - Aryl bromide - Aryl chloride - Aryl halide - 1,3-diazinane - Thiourea - Carboxylic acid derivative - Azacycle - Organoheterocyclic compound - Hydrazone - Organooxygen compound - Organic oxide - Organosulfur compound - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organohalogen compound - Organobromide - Organochloride - Organonitrogen compound - Aromatic heteromonocyclic 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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