Compound Identification
SMILES
CCC(N1C(=O)CSC2=C1C=C(C=C2)C(C)(C)C)C(=O)NCC[NH+](CC)CC
InChIKey
InChIKey=BWPCGAHAQWZZHZ-UHFFFAOYSA-O
Formula
C22H36N3O2S
Mass
406.61
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 Alkylarylthioethers N-acyl amines Benzenoids 1,4-thiazines Tertiary carboxylic acid amides Quaternary ammonium salts Trialkylamines Secondary carboxylic acid amides Lactams Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-amino acid or derivatives - Benzothiazine - Aryl thioether - Alkylarylthioether - Para-thiazine - Fatty amide - N-acyl-amine - Fatty acyl - Benzenoid - Quaternary ammonium salt - Tertiary carboxylic acid amide - Amino acid or derivatives - Carboxamide group - Lactam - Secondary carboxylic acid amide - Tertiary amine - Tertiary aliphatic amine - Azacycle - Carboxylic acid derivative - Thioether - Organonitrogen compound - Amine - Hydrocarbon derivative - Organic oxygen compound - Carbonyl group - Organooxygen compound - Organic nitrogen compound - Organic oxide - 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