Structure Information
Structure

Compound Identification

SMILES

CCC(=O)OC1=C(Cl)C=C(Cl)C=C1[C@H]1OC2=C(N=NC(SC)=N2)C2=CC=CC=C2N1C(=O)CC

InChIKey

InChIKey=NSFCVZFXTFCMBI-JOCHJYFZSA-N

Formula

C23H20Cl2N4O4S

Mass

519.4

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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 - Phenol ester - Phenoxy compound - Aryl thioether - 1,3-dichlorobenzene - Meta-oxazepine - Halobenzene - Chlorobenzene - Alkylarylthioether - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Triazine - 1,2,4-triazine - Benzenoid - Tertiary carboxylic acid amide - Heteroaromatic compound - Carboxamide group - Carboxylic acid ester - Oxacycle - Carboxylic acid derivative - Azacycle - Sulfenyl compound - Thioether - Monocarboxylic acid or derivatives - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Organosulfur compound - Hydrocarbon derivative - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - 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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