Structure Information
Structure

Compound Identification

SMILES

CCSC1=NC2=C(N=N1)C1=CC=CC=C1N([C@H](O2)C1=CC=CC=C1[N+]([O-])=O)C(C)=O

InChIKey

InChIKey=WSYNCRRWXNSKSS-LJQANCHMSA-N

Formula

C20H17N5O4S

Mass

423.45

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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 - Nitrobenzene - Aryl thioether - Nitroaromatic compound - Meta-oxazepine - Alkylarylthioether - Monocyclic benzene moiety - 1,2,4-triazine - Triazine - Benzenoid - Heteroaromatic compound - Tertiary carboxylic acid amide - Acetamide - Carboxamide group - C-nitro compound - Organic nitro compound - Carboxylic acid derivative - Oxacycle - Organic oxoazanium - Azacycle - Thioether - Sulfenyl compound - Organic 1,3-dipolar compound - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Organosulfur compound - Organopnictogen compound - Carbonyl group - Organic salt - Organic oxide - Organic zwitterion - Organic nitrogen compound - Hydrocarbon derivative - 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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