Compound Identification
SMILES
CC(C)[NH+](CCNC(=O)CN1C(=O)C(SC2=CC=CC=C12)=CC1=CC=C(Cl)C=C1)CC1=CC=CC=C1
InChIKey
InChIKey=PKHJGHLROMYTSB-UHFFFAOYSA-O
Formula
C29H31ClN3O2S
Mass
521.1
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 Phenylmethylamines Aryl thioethers Benzylamines Aralkylamines Chlorobenzenes 1,4-thiazines Aryl chlorides Tertiary carboxylic acid amides Quaternary ammonium salts Trialkylamines Thioenol ethers Secondary carboxylic acid amides Lactams Azacyclic compounds Organic oxides Carbonyl compounds Organochlorides Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-amino acid or derivatives - Benzothiazine - Aryl thioether - Benzylamine - Phenylmethylamine - Chlorobenzene - Halobenzene - Aralkylamine - Para-thiazine - Aryl chloride - Benzenoid - Aryl halide - Monocyclic benzene moiety - Tertiary carboxylic acid amide - Quaternary ammonium salt - Tertiary amine - Thioenolether - Tertiary aliphatic amine - Carboxamide group - Lactam - Amino acid or derivatives - Secondary carboxylic acid amide - Carboxylic acid derivative - Azacycle - Organic nitrogen compound - Organic oxygen compound - Organohalogen compound - Carbonyl group - Organochloride - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Amine - 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