Structure Information
Structure

Compound Identification

SMILES

CC1=CC(NC2=NC(NC3=CC4=C(NC=C4)C=C3)=NC=C2C(N)=O)=CC=C1

InChIKey

InChIKey=LYUBNKQPZHJTMK-UHFFFAOYSA-N

Formula

C20H18N6O

Mass

358.405

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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 - Pyrimidinecarboxamide - Pyrimidine-5-carboxylic acid or derivatives - Aniline or substituted anilines - Aminopyrimidine - Toluene - Monocyclic benzene moiety - Pyrimidine - Imidolactam - Benzenoid - Heteroaromatic compound - Pyrrole - Vinylogous amide - Primary carboxylic acid amide - Carboxamide group - Amino acid or derivatives - Azacycle - Carboxylic acid derivative - Secondary amine - Amine - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organic oxide - Organic oxygen compound - 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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