Structure Information
Structure

Compound Identification

SMILES

CN1CC=C2[C@H](C1)[C@@H](C1=CC=C(Br)S1)C(C#N)(C#N)C(N)=C2C#N

InChIKey

InChIKey=XWHGWLWVQHNFFY-WFASDCNBSA-N

Formula

C17H14BrN5S

Mass

400.3

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organic nitrogen compounds

Class

Organonitrogen compounds

Subclass

Amines

Intermediate Tree Nodes

Not available

Direct Parent

Aralkylamines

Alternative Parents

2,5-disubstituted thiophenes Aryl bromides Heteroaromatic compounds Trialkylamines Nitriles Enamines Azacyclic compounds Organobromides Monoalkylamines Hydrocarbon derivatives

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Aralkylamine - 2,5-disubstituted thiophene - Aryl bromide - Aryl halide - Heteroaromatic compound - Thiophene - Tertiary amine - Tertiary aliphatic amine - Azacycle - Nitrile - Carbonitrile - Enamine - Organoheterocyclic compound - Primary amine - Organobromide - Organohalogen compound - Primary aliphatic amine - Hydrocarbon derivative - Cyanide - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as aralkylamines. These are alkylamines in which the alkyl group is substituted at one carbon atom by an aromatic hydrocarbyl group.

External Descriptors

Not available

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