Structure Information
Structure

Compound Identification

SMILES

CC[NH+](CC)C[C@H](O)C1=CC2=C(S1)C=CC(Br)=C2

InChIKey

InChIKey=RQLHMDGRXVRMOL-LBPRGKRZSA-O

Formula

C14H19BrNOS

Mass

329.28

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Benzothiophenes

Subclass

1-benzothiophenes

Intermediate Tree Nodes

Not available

Direct Parent

1-benzothiophenes

Alternative Parents

2,3,5-trisubstituted thiophenes Aralkylamines Benzenoids Aryl bromides Quaternary ammonium salts Heteroaromatic compounds Trialkylamines Secondary alcohols 1,2-aminoalcohols Organobromides Hydrocarbon derivatives Aromatic alcohols Organic cations

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

1-benzothiophene - 2,3,5-trisubstituted thiophene - Aralkylamine - Aryl bromide - Aryl halide - Benzenoid - Quaternary ammonium salt - Heteroaromatic compound - Thiophene - 1,2-aminoalcohol - Secondary alcohol - Tertiary amine - Tertiary aliphatic amine - Alcohol - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organobromide - Organohalogen compound - Organic oxygen compound - Organic nitrogen compound - Amine - Aromatic alcohol - Organic cation - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as 1-benzothiophenes. These are aromatic heterocyclic compound containing the Benzo[b]thiophene ring system.

External Descriptors

Not available

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