Structure Information
Structure

Compound Identification

SMILES

[O-][N+](=O)C1=CC=CC(=C1)C1=CC=C(O1)C(=O)NC(=S)NC1=C(I)C=C(Br)C=C1

InChIKey

InChIKey=UAJCGZIDQBWGTD-UHFFFAOYSA-N

Formula

C18H11BrIN3O4S

Mass

572.17

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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 - Nitrobenzene - Furoic acid or derivatives - Nitroaromatic compound - Furancarboxamide - Iodobenzene - Halobenzene - Bromobenzene - N-acyl-amine - Heteroaromatic compound - Furan - Organic nitro compound - C-nitro compound - Carboxamide group - Oxacycle - Iodoalkene - Bromoalkene - Haloalkene - Organoheterocyclic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Vinyl iodide - Vinyl halide - Vinyl bromide - Organic oxoazanium - Carboxylic acid derivative - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organic zwitterion - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organoiodide - Organobromide - Organic hyponitrite - Organohalogen 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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