Structure Information
Structure

Compound Identification

SMILES

CCNC(=O)NC1=C(C(=O)N2CCN(CC2)SC2=CC(Br)=C(N=C2)N(CC)CC)C2=CC=CC=C2S1

InChIKey

InChIKey=YGRBCLPIPCTAJY-UHFFFAOYSA-N

Formula

C25H31BrN6O2S2

Mass

591.59

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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

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

1-benzothiophene - Dialkylarylamine - Thiophene carboxamide - Thiophene carboxylic acid or derivatives - Aminopyridine - Aryl bromide - Aryl halide - 1,4-diazinane - Piperazine - Pyridine - Imidolactam - Benzenoid - Heteroaromatic compound - Tertiary carboxylic acid amide - Vinylogous amide - Thiophene - Urea - Carboxamide group - Organosulfenic acid amide - Azacycle - Sulfenyl compound - Carboxylic acid derivative - Organic nitrogen compound - Organonitrogen compound - Organobromide - Organohalogen compound - Hydrocarbon derivative - Organooxygen compound - Organosulfur compound - Carbonyl group - Organic oxide - Amine - Organic oxygen compound - 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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