Structure Information
Structure

Compound Identification

SMILES

NC1=NC(=NO1)C1=C2NC=C(C(=O)C(=O)N3CCN(CC3)C(=O)C3=CC=CC=N3)C2=C(F)C=C1

InChIKey

InChIKey=XKPSRJBNCRODMN-UHFFFAOYSA-N

Formula

C22H18FN7O4

Mass

463.429

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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 - Pyridine carboxylic acid or derivatives - 2-heteroaryl carboxamide - Aryl ketone - Aryl fluoride - Aryl halide - 1,4-diazinane - Piperazine - Pyridine - Substituted pyrrole - Benzenoid - 1,2,4-oxadiazole - Azole - Oxadiazole - Heteroaromatic compound - Pyrrole - Tertiary carboxylic acid amide - Vinylogous amide - Carboxamide group - Amino acid or derivatives - Ketone - Azacycle - Oxacycle - Carboxylic acid derivative - Organooxygen compound - Organic oxide - Organopnictogen compound - Amine - Hydrocarbon derivative - Carbonyl group - Primary amine - Organic oxygen compound - Organic nitrogen compound - Organohalogen compound - Organofluoride - Organonitrogen 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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