Structure Information
Structure

Compound Identification

SMILES

O=C1NC(=O)\C(S1)=C\C1=NC(=NC=C1)N1CCC(CNC2=NC3=CC=CC=C3C2)CC1

InChIKey

InChIKey=IBPSCFUKEKMCPB-PDGQHHTCSA-N

Formula

C22H22N6O2S

Mass

434.52

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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

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Indole - Dialkylarylamine - Aminopyrimidine - Thiazolidinedione - Piperidine - Pyrimidine - Imidolactam - Benzenoid - Dicarboximide - Heteroaromatic compound - Thiazolidine - Amino acid or derivatives - Tertiary amine - Thiocarbamic acid derivative - Azacycle - Carboxylic acid derivative - Carboxylic acid amidine - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Amidine - Amine - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organic oxide - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - 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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