Compound Identification
SMILES
CCOC(=O)N1CCN(CC1)C(=O)C1=CC2=C(SC([NH+]3CCOCC3)C(=O)N2)C=C1
InChIKey
InChIKey=ZRBSZASLOBTMOB-UHFFFAOYSA-O
Formula
C20H27N4O5S
Mass
435.52
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 Piperazine carboxylic acids Alkylarylthioethers 1,4-thiazines Morpholines Benzenoids Tertiary carboxylic acid amides Quaternary ammonium salts Carbamate esters Secondary carboxylic acid amides Lactams Oxacyclic compounds Dialkyl ethers Azacyclic compounds Organic oxides Carbonyl compounds Amines Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-amino acid or derivatives - Benzothiazine - Piperazine-1-carboxylic acid - Aryl thioether - Alkylarylthioether - Para-thiazine - 1,4-diazinane - Morpholine - Oxazinane - Piperazine - Benzenoid - Carbamic acid ester - Tertiary carboxylic acid amide - Quaternary ammonium salt - Carboxamide group - Lactam - Secondary carboxylic acid amide - Azacycle - Ether - Dialkyl ether - Carboxylic acid derivative - Oxacycle - Thioether - Organooxygen compound - Organonitrogen compound - Amine - Organic nitrogen compound - Carbonyl group - Organic oxide - Organic oxygen compound - Hydrocarbon derivative - 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