Compound Identification
SMILES
COC1=CC(CCN2CCN(CCCCOC3=CC=CC=C3[N+]3(CC4=CC=CC=C4)C(=O)C(C)C4=CC=CC=C4S3(=O)=O)CC2)=CC(OC)=C1OC
InChIKey
InChIKey=YQFOYBLZZAJNMP-UHFFFAOYSA-N
Formula
C41H50N3O7S
Mass
728.92
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
Sulfanilides Phenethylamines Anisoles Phenoxy compounds Methoxybenzenes Alkyl aryl ethers Aralkylamines N-alkylpiperazines 1,2-thiazines Organosulfonic acids and derivatives Trialkylamines Amino acids and derivatives Azacyclic compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzothiazine - Sulfanilide - Phenethylamine - Phenoxy compound - Anisole - Phenol ether - Methoxybenzene - Alkyl aryl ether - Aralkylamine - N-alkylpiperazine - Ortho-thiazine - Monocyclic benzene moiety - 1,4-diazinane - Piperazine - Benzenoid - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Tertiary aliphatic amine - Amino acid or derivatives - Tertiary amine - Azacycle - Carboxylic acid derivative - Ether - Organic oxygen compound - Carbonyl group - Organic oxide - Organic nitrogen compound - Organooxygen compound - Hydrocarbon derivative - Amine - Organonitrogen compound - 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