Structure Information
Structure

Compound Identification

SMILES

CCOC(=O)C1=C2N3CCCCCC3=NN2C(=O)NC1(C1=CC=CC=C1)C(F)(F)F

InChIKey

InChIKey=MXDGSMOCFGGJKN-UHFFFAOYSA-N

Formula

C20H21F3N4O3

Mass

422.408

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Azepanes

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Azepanes

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Azepane - Pyrimidone - 1,2,3,4-tetrahydropyrimidine - Hydropyrimidine - Pyrimidine - Monocyclic benzene moiety - Benzenoid - Imidolactam - Triazoline - Semicarbazide - Enoate ester - Alpha,beta-unsaturated carboxylic ester - Vinylogous amide - Ketene acetal or derivatives - Carboxylic acid amidrazone - Carboxylic acid ester - Carboxylic acid derivative - Azacycle - Monocarboxylic acid or derivatives - Amidine - Alkyl fluoride - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Amine - Organic oxygen compound - Organic nitrogen compound - Alkyl halide - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as azepanes. These are organic compounds containing a saturated seven member heterocycle, with one nitrogen atom.

External Descriptors

Not available

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