Compound Identification
SMILES
OC(=O)C(O)=O.CCN(CC)CC(=O)N1CC(SC2=CC=CC=C12)C1=CC=C(Cl)C=C1
InChIKey
InChIKey=YCJOETBYXYTCSC-UHFFFAOYSA-N
Formula
C22H25ClN2O5S
Mass
464.96
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
Alpha amino acids and derivatives Chlorobenzenes Alkylarylthioethers Dicarboxylic acids and derivatives Aryl chlorides 1,4-thiazines Tertiary carboxylic acid amides Trialkylamines Carboxylic acids Azacyclic compounds Organochlorides Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Not available
Substituents
Alpha-amino acid or derivatives - Benzothiazine - Aryl thioether - Chlorobenzene - Halobenzene - Alkylarylthioether - Para-thiazine - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Dicarboxylic acid or derivatives - Benzenoid - Tertiary carboxylic acid amide - Tertiary aliphatic amine - Tertiary amine - Amino acid or derivatives - Carboxamide group - Carboxylic acid - Carboxylic acid derivative - Thioether - Azacycle - Organic oxide - Carbonyl group - Organic oxygen compound - Amine - Organic nitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organohalogen compound - Organochloride - Organonitrogen compound - 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