Compound Identification
SMILES
CC1C(=O)[N+](C)(SC2=CC=CC=C12)C1=C(OCCCCBr)C=CC(Cl)=C1
InChIKey
InChIKey=RBXXPRSQFGYSMY-UHFFFAOYSA-N
Formula
C20H22BrClNO2S
Mass
455.81
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Benzothiazines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzothiazines
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Benzothiazines
Alternative Parents
Phenoxy compounds Phenol ethers Alkyl aryl ethers Chlorobenzenes 1,2-thiazines Aryl chlorides Azacyclic compounds Carboxylic acids and derivatives Organonitrogen compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides Organobromides Alkyl bromides Organochlorides Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzothiazine - Phenoxy compound - Phenol ether - Alkyl aryl ether - Chlorobenzene - Halobenzene - Ortho-thiazine - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Azacycle - Carboxylic acid derivative - Ether - Organochloride - Organooxygen compound - Hydrocarbon derivative - Organohalogen compound - Organic oxide - Organobromide - Carbonyl group - Organic oxygen compound - Alkyl halide - Alkyl bromide - Organic nitrogen compound - Organonitrogen compound - Organic cation - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as benzothiazines. These are organic compounds containing a benzene fused to a thiazine ring (a six-membered ring with four carbon atoms, one nitrogen atom and one sulfur atom).
External Descriptors
Not available