Structure Information
Structure

Compound Identification

SMILES

CNC(=O)C1=C(NC2=NC(NC3=CC4=C(C=C3)C(C)(C)CC(NC(=O)OC)C(=O)N4)=NC=C2Cl)C(F)=CC=C1

InChIKey

InChIKey=XMKAFTZMVDNUII-UHFFFAOYSA-N

Formula

C26H27ClFN7O4

Mass

556.0

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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 - Alpha-amino acid or derivatives - 3-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Benzamide - Benzoic acid or derivatives - Benzoyl - Aniline or substituted anilines - Aminopyrimidine - Azepine - Fluorobenzene - Halobenzene - Halopyrimidine - Imidolactam - Pyrimidine - Benzenoid - Aryl chloride - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Carbamic acid ester - Vinylogous amide - Methylcarbamate - Heteroaromatic compound - Secondary carboxylic acid amide - Amino acid or derivatives - Lactam - Carboxamide group - Azacycle - Secondary amine - Carboxylic acid derivative - Carbonyl group - Organooxygen compound - Organohalogen compound - Hydrocarbon derivative - Organic oxygen compound - Organochloride - Organofluoride - Organonitrogen compound - Amine - Organic oxide - 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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