Structure Information
Structure

Compound Identification

SMILES

CC1=CC(C)=C(C=C1)N1C(=O)C(SC1=C(C#N)C#N)=CC1=CC=C(Br)C=C1

InChIKey

InChIKey=RGJMYLCQJUXJBC-UHFFFAOYSA-N

Formula

C21H14BrN3OS

Mass

436.33

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Xylenes

Intermediate Tree Nodes

Not available

Direct Parent

m-Xylenes

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

M-xylene - Bromobenzene - Halobenzene - Aryl bromide - Aryl halide - Azole - Thiazole - Heteroaromatic compound - Lactam - Organoheterocyclic compound - Nitrile - Carbonitrile - Azacycle - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Organobromide - Organohalogen compound - Organic oxide - Cyanide - Organic oxygen compound - Hydrocarbon derivative - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as m-xylenes. These are aromatic compounds that contain a m-xylene moiety, which is a monocyclic benzene carrying exactly two methyl groups at the 1- and 3-positions.

External Descriptors

Not available

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