Structure Information
Structure

Compound Identification

SMILES

OC1=CC=C(C=C1)C(=O)NNC(=S)NC(=O)C1=CC=CC=C1I

InChIKey

InChIKey=BYWXXUIGQGBIMV-UHFFFAOYSA-N

Formula

C15H12IN3O3S

Mass

441.24

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Benzoic acids and derivatives

Intermediate Tree Nodes

Halobenzoic acids and derivatives

Direct Parent

2-halobenzoic acids and derivatives

Alternative Parents

Molecular Framework

Aromatic homomonocyclic compounds

Substituents

2-halobenzoic acid or derivatives - Benzoyl - 1-hydroxy-2-unsubstituted benzenoid - Halobenzene - Iodobenzene - Phenol - Aryl halide - Aryl iodide - Vinylogous halide - Thiosemicarbazide - Carboxylic acid hydrazide - Carboxylic acid derivative - Organooxygen compound - Organonitrogen compound - Organoiodide - Organohalogen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Organosulfur compound - Aromatic homomonocyclic compound

Description

This compound belongs to the class of organic compounds known as 2-halobenzoic acids and derivatives. These are benzoic acids or derivatives carrying a halogen atom at the 2-position of the benzene ring.

External Descriptors

Not available

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