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
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Benzoxazepines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzoxazepines
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Benzoxazepines
Alternative Parents
Secondary alkylarylamines 1,3-oxazepines Alkylarylthioethers Chlorobenzenes Fluorobenzenes 1,2,4-triazines Aryl chlorides Aryl fluorides Heteroaromatic compounds Furans Azacyclic compounds Sulfenyl compounds Oxacyclic compounds Hydrocarbon derivatives Organochlorides Organofluorides Organooxygen compounds
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