Structure Information
Structure

Compound Identification

SMILES

OC(CNC1=CC=C(Br)C=C1)CSC1=NN=C(NCC2=CNC3=CC=CC=C23)S1

InChIKey

InChIKey=HLAVCTFBALBVDX-UHFFFAOYSA-N

Formula

C20H20BrN5OS2

Mass

490.44

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Indoles and derivatives

Subclass

Indoles

Intermediate Tree Nodes

Not available

Direct Parent

3-alkylindoles

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

3-alkylindole - Aryl thioether - Aniline or substituted anilines - Phenylalkylamine - Bromobenzene - Halobenzene - Secondary aliphatic/aromatic amine - Alkylarylthioether - 2-amino-5-substituted-1,3,4-thiadiazole - 2-amino-1,3,4-thiadiazole - Benzenoid - Aryl bromide - Aryl halide - Substituted pyrrole - Monocyclic benzene moiety - Heteroaromatic compound - Thiadiazole - Azole - Pyrrole - Secondary alcohol - 1,2-aminoalcohol - Azacycle - Sulfenyl compound - Thioether - Secondary amine - Alcohol - Organosulfur compound - Amine - Hydrocarbon derivative - Organic nitrogen compound - Organic oxygen compound - Organohalogen compound - Organobromide - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as 3-alkylindoles. These are compounds containing an indole moiety that carries an alkyl chain at the 3-position.

External Descriptors

Not available

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