Compound Identification
SMILES
CSC1=NC2=C(N=N1)C1=CC=CC=C1NC(O2)C1=C(Br)C(O)=C(Br)C=C1Br
InChIKey
InChIKey=YODNHYDWBVWOCM-UHFFFAOYSA-N
Formula
C17H11Br3N4O2S
Mass
575.07
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
P-bromophenols O-bromophenols Bromobenzenes Alkylarylthioethers 1,3-oxazepines Aryl bromides 1,2,4-triazines Heteroaromatic compounds Sulfenyl compounds Oxacyclic compounds Azacyclic compounds Organooxygen compounds Organobromides Hydrocarbon derivatives Amines
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzoxazepine - Aryl thioether - 4-halophenol - 2-halophenol - 2-bromophenol - 4-bromophenol - Meta-oxazepine - Bromobenzene - Halobenzene - Alkylarylthioether - Phenol - Aryl bromide - Aryl halide - Monocyclic benzene moiety - 1,2,4-triazine - Benzenoid - Triazine - Heteroaromatic compound - Azacycle - Oxacycle - Sulfenyl compound - Thioether - Organonitrogen compound - Organobromide - Organohalogen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxygen compound - Organooxygen compound - Organosulfur compound - Amine - 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