Structure Information
Structure

Compound Identification

SMILES

OCCNC1=NC(N2CCC3=CC=CC=C3CC2)=C(C#N)C(OCC(F)(F)F)=N1

InChIKey

InChIKey=BRJWSWOUTCHPTG-UHFFFAOYSA-N

Formula

C19H20F3N5O2

Mass

407.397

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Benzazepines

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Benzazepines

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Benzazepine - Dialkylarylamine - Alkyl aryl ether - Aminopyrimidine - Azepine - Imidolactam - Benzenoid - Pyrimidine - Heteroaromatic compound - Alkanolamine - Azacycle - Ether - Carbonitrile - Nitrile - Alcohol - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Primary alcohol - Hydrocarbon derivative - Cyanide - Amine - Alkyl halide - Alkyl fluoride - Organic oxygen compound - Organic nitrogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as benzazepines. These are organic compounds containing a benzene ring fused to an azepine ring (unsaturated seven-membered heterocycle with one nitrogen atom replacing a carbon atom).

External Descriptors

Not available

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