Structure Information
Structure

Compound Identification

SMILES

CSC1=NC2=C(N=N1)C1=C(C=CC(Br)=C1)N(C(O2)C1=C(Cl)N(N=C1C)C1=CC=CC=C1)C(C)=O

InChIKey

InChIKey=WCZXAMFYUCOYSW-UHFFFAOYSA-N

Formula

C23H18BrClN6O2S

Mass

557.85

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Benzoxazepines

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Benzoxazepines

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Benzoxazepine - Phenylpyrazole - Aryl thioether - Meta-oxazepine - Alkylarylthioether - Aryl bromide - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Triazine - Benzenoid - 1,2,4-triazine - Heteroaromatic compound - Tertiary carboxylic acid amide - Pyrazole - Acetamide - Azole - Tertiary amine - Amino acid or derivatives - Carboxamide group - Sulfenyl compound - Thioether - Oxacycle - Azacycle - Carboxylic acid derivative - Organic oxide - Organohalogen compound - Organobromide - Carbonyl group - Organic nitrogen compound - Organochloride - Hydrocarbon derivative - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Amine - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as benzoxazepines. These are organic compounds containing a benzene fused to an oxazepine ring (a seven-membered ring with four carbon atoms, one oxygen atom, and a nitrogen atom).

External Descriptors

Not available

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