Compound Identification
SMILES
CCCCCCSC1=NC2=C(N=N1)C1=CC=CC=C1N([C@@H](O2)C1=CC(Br)=CC(OC)=C1OC)C(C)=O
InChIKey
InChIKey=UFLXRWIEOOSESJ-VWLOTQADSA-N
Formula
C26H29BrN4O4S
Mass
573.51
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
Dimethoxybenzenes Anisoles Phenoxy compounds 1,3-oxazepines Alkyl aryl ethers Alkylarylthioethers Bromobenzenes Aryl bromides 1,2,4-triazines Heteroaromatic compounds Tertiary carboxylic acid amides Acetamides Sulfenyl compounds Azacyclic compounds Oxacyclic compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides Organobromides Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzoxazepine - Dimethoxybenzene - O-dimethoxybenzene - Phenol ether - Phenoxy compound - Aryl thioether - Anisole - Methoxybenzene - Meta-oxazepine - Halobenzene - Alkylarylthioether - Bromobenzene - Alkyl aryl ether - Benzenoid - 1,2,4-triazine - Triazine - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Heteroaromatic compound - Acetamide - Tertiary carboxylic acid amide - Carboxamide group - Thioether - Oxacycle - Azacycle - Sulfenyl compound - Ether - Carboxylic acid derivative - Organic oxide - Organohalogen compound - Carbonyl group - Organic oxygen compound - Organobromide - Organonitrogen compound - Organic nitrogen compound - Hydrocarbon derivative - Organosulfur compound - Organooxygen 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