Structure Information
Structure

Compound Identification

SMILES

CCN1C(C)=CS\C1=N\NC=C1C=C(Br)C=C(Br)C1=O

InChIKey

InChIKey=LKNMMQZCZRPGGY-HVXNJBCNSA-N

Formula

C13H13Br2N3OS

Mass

419.14

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organic oxygen compounds

Class

Organooxygen compounds

Subclass

Carbonyl compounds

Intermediate Tree Nodes

Ketones - Cyclic ketones - Quinomethanes

Direct Parent

O-quinomethanes

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

O-quinomethane - Azole - Alpha-haloketone - Thiazole - Vinylogous amide - Heteroaromatic compound - Bromoalkene - Haloalkene - Organoheterocyclic compound - Vinyl halide - Vinyl bromide - Hydrazone - Azacycle - Organonitrogen compound - Organobromide - Organohalogen compound - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as o-quinomethanes. These are organic compounds containing a benzene ring conjugated to a methylidene group and a ketone at carbon atoms 1 and 2, respectively.

External Descriptors

Not available

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