Compound Identification
SMILES
CC(C)[N+]1(C(=O)C(C)C2=CC=CC=C2S1(=O)=O)C1=C(OCC#CCCl)C=CC(F)=C1
InChIKey
InChIKey=YTQXKJSTILWIBI-UHFFFAOYSA-N
Formula
C22H22ClFNO4S
Mass
450.93
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
Sulfanilides Phenoxy compounds Phenol ethers Alkyl aryl ethers Fluorobenzenes 1,2-thiazines Aryl fluorides Organosulfonic acids and derivatives Azacyclic compounds Carboxylic acids and derivatives Organonitrogen compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides Organochlorides Alkyl chlorides Organofluorides Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzothiazine - Sulfanilide - Phenoxy compound - Phenol ether - Alkyl aryl ether - Fluorobenzene - Halobenzene - Ortho-thiazine - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Ether - Carboxylic acid derivative - Azacycle - Organofluoride - Organochloride - Organohalogen compound - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organonitrogen compound - Alkyl halide - Alkyl chloride - 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