Structure Information
Structure

Compound Identification

SMILES

C[C@H]1CCC[C@@H](C)N1C(=O)CSC1=NC2=C(N=N1)C1=C(N2)C=CC(Br)=C1

InChIKey

InChIKey=KQYQMHPCLNVXLU-PHIMTYICSA-N

Formula

C18H20BrN5OS

Mass

434.36

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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

Indoles

Alternative Parents

N-acylpiperidines Alkylarylthioethers Benzenoids Aryl bromides 1,2,4-triazines Tertiary carboxylic acid amides Pyrroles Heteroaromatic compounds Sulfenyl compounds Azacyclic compounds Organonitrogen compounds Organobromides Organic oxides Hydrocarbon derivatives Carbonyl compounds

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Indole - N-acyl-piperidine - Aryl thioether - Alkylarylthioether - Aryl bromide - Aryl halide - Piperidine - Triazine - Benzenoid - 1,2,4-triazine - Heteroaromatic compound - Tertiary carboxylic acid amide - Pyrrole - Carboxamide group - Sulfenyl compound - Thioether - Azacycle - Carboxylic acid derivative - Hydrocarbon derivative - Organonitrogen compound - Organobromide - Organohalogen compound - Organic oxygen compound - Organic nitrogen compound - Organooxygen compound - Organic oxide - Organosulfur compound - Carbonyl group - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as indoles. These are compounds containing an indole moiety, which consists of pyrrole ring fused to benzene to form 2,3-benzopyrrole.

External Descriptors

Not available

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