Structure Information
Structure

Compound Identification

SMILES

CC1=NC(C(=O)N2CCNC[C@H]2CNC(=O)N2CCC3=C2C=C(F)C=C3)=C(S1)C1=CC=C(F)C=C1

InChIKey

InChIKey=JBPOUBSAYUHBIL-FQEVSTJZSA-N

Formula

C25H25F2N5O2S

Mass

497.56

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Indoles and derivatives

Subclass

Indolecarboxylic acids and derivatives

Intermediate Tree Nodes

Not available

Direct Parent

Indolecarboxylic acids and derivatives

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Indolecarboxylic acid derivative - 2-heteroaryl carboxamide - 2,4,5-trisubstituted 1,3-thiazole - Thiazolecarboxylic acid or derivatives - Thiazolecarboxamide - Fluorobenzene - Halobenzene - 1,4-diazinane - Aryl fluoride - Aryl halide - Benzenoid - Monocyclic benzene moiety - Piperazine - Heteroaromatic compound - Thiazole - Azole - Tertiary carboxylic acid amide - Carboxamide group - Urea - Amino acid or derivatives - Carboxylic acid derivative - Secondary aliphatic amine - Azacycle - Secondary amine - Organic nitrogen compound - Organohalogen compound - Organofluoride - Carbonyl group - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Amine - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as indolecarboxylic acids and derivatives. These are compounds containing a carboxylic acid group (or a derivative thereof) linked to an indole.

External Descriptors

Not available

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