Compound Identification
SMILES
CC[NH+](CCCNC(=O)C1=CC2=C(SC(=CC3=CC=CC=C3)C(=O)N2CC2=CC=CC(C)=C2)C=C1)CC1=CC=CC=C1
InChIKey
InChIKey=MDBVYNFVMZBDPU-UHFFFAOYSA-O
Formula
C36H38N3O2S
Mass
576.78
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
Phenylmethylamines Aryl thioethers Benzylamines Toluenes Aralkylamines 1,4-thiazines Tertiary carboxylic acid amides Quaternary ammonium salts Trialkylamines Thioenol ethers Secondary carboxylic acid amides Amino acids and derivatives Lactams Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzothiazine - Aryl thioether - Benzylamine - Phenylmethylamine - Aralkylamine - Toluene - Para-thiazine - Monocyclic benzene moiety - Benzenoid - Quaternary ammonium salt - Tertiary carboxylic acid amide - Amino acid or derivatives - Carboxamide group - Lactam - Secondary carboxylic acid amide - Tertiary amine - Tertiary aliphatic amine - Thioenolether - Carboxylic acid derivative - Azacycle - Organonitrogen compound - Organic nitrogen compound - Amine - Carbonyl group - Organooxygen compound - Organic oxygen compound - Organic oxide - 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