Compound Identification
SMILES
COC1=C(Br)C=C(C=C2SC3=CC=CC=C3N(CC(=O)NCC[NH+]3CCCCCC3)C2=O)C=C1
InChIKey
InChIKey=SVILQSYFHYTYHM-UHFFFAOYSA-O
Formula
C26H31BrN3O3S
Mass
545.52
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 Anisoles Aryl thioethers Methoxybenzenes Phenoxy compounds Alkyl aryl ethers Azepanes Bromobenzenes Aryl bromides 1,4-thiazines Tertiary carboxylic acid amides Quaternary ammonium salts Lactams Thioenol ethers Secondary carboxylic acid amides Trialkylamines Azacyclic compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides Organobromides Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-amino acid or derivatives - Benzothiazine - Phenol ether - Phenoxy compound - Aryl thioether - Anisole - Methoxybenzene - Azepane - Halobenzene - Alkyl aryl ether - Bromobenzene - Monocyclic benzene moiety - Aryl bromide - Para-thiazine - Benzenoid - Aryl halide - Tertiary carboxylic acid amide - Quaternary ammonium salt - Amino acid or derivatives - Carboxamide group - Tertiary aliphatic amine - Secondary carboxylic acid amide - Tertiary amine - Thioenolether - Lactam - Ether - Azacycle - Carboxylic acid derivative - Organic nitrogen compound - Organic oxygen compound - Carbonyl group - Organohalogen compound - Organobromide - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Amine - 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