Structure Information
Structure

Compound Identification

SMILES

NC1=C(C#N)[C@@H](C2=CC(Br)=CC=C2)C(C#N)=C(S)N1

InChIKey

InChIKey=SRYHWYLCJGWKHZ-LLVKDONJSA-N

Formula

C13H9BrN4S

Mass

333.21

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Halobenzenes

Intermediate Tree Nodes

Not available

Direct Parent

Bromobenzenes

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Bromobenzene - Dihydropyridine - Aryl bromide - Aryl halide - Hydropyridine - Ketene acetal or derivatives - Alkylthiol - Secondary aliphatic amine - Azacycle - Organoheterocyclic compound - Secondary amine - Carbonitrile - Nitrile - Organopnictogen compound - Organic nitrogen compound - Primary aliphatic amine - Hydrocarbon derivative - Amine - Organohalogen compound - Organobromide - Organonitrogen compound - Organosulfur compound - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as bromobenzenes. These are organic compounds containing a bromine atom attached to a benzene ring.

External Descriptors

Not available

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