Compound Identification
SMILES
CN(C)C1=CC=C(C=C1)C1NC2=CC=CC=C2C2=C(O1)N=C(SCC1=CC=C(Cl)C=C1)N=N2
InChIKey
InChIKey=YYTSPXHQOGZNRF-UHFFFAOYSA-N
Formula
C25H22ClN5OS
Mass
476.0
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
Dialkylarylamines Aniline and substituted anilines Chlorobenzenes Alkylarylthioethers 1,3-oxazepines Aryl chlorides 1,2,4-triazines Heteroaromatic compounds Sulfenyl compounds Oxacyclic compounds Azacyclic compounds Organooxygen compounds Organochlorides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzoxazepine - Aryl thioether - Tertiary aliphatic/aromatic amine - Dialkylarylamine - Aniline or substituted anilines - Meta-oxazepine - Chlorobenzene - Halobenzene - Alkylarylthioether - 1,2,4-triazine - Aryl chloride - Benzenoid - Triazine - Aryl halide - Monocyclic benzene moiety - Heteroaromatic compound - Tertiary amine - Oxacycle - Azacycle - Sulfenyl compound - Thioether - Organohalogen compound - Amine - Organic nitrogen compound - Organic oxygen compound - Hydrocarbon derivative - Organochloride - Organonitrogen compound - Organooxygen compound - Organosulfur 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