Structure Information
Structure

Compound Identification

SMILES

FC1=CC=CC=C1CSC1=NC2=C(N=N1)C1=CC=CC=C1NC(O2)C1=CC=C(O1)C1=CC(Cl)=CC=C1

InChIKey

InChIKey=YDHKXBXYGCHNCD-UHFFFAOYSA-N

Formula

C27H18ClFN4O2S

Mass

516.98

Export to:

JSON SDF CSV

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 - Aryl thioether - Meta-oxazepine - Chlorobenzene - Fluorobenzene - Halobenzene - Secondary aliphatic/aromatic amine - Alkylarylthioether - 1,2,4-triazine - Monocyclic benzene moiety - Aryl chloride - Aryl fluoride - Triazine - Benzenoid - Aryl halide - Furan - Heteroaromatic compound - Sulfenyl compound - Azacycle - Thioether - Secondary amine - Oxacycle - Hydrocarbon derivative - Organohalogen compound - Amine - Organic nitrogen compound - Organochloride - Organofluoride - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic oxygen 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

Previous Back Next