Compound Identification
SMILES
[O-]S([O-])(=O)=O.CCN(CCO)C1=CC=C(C=C1)N=NC1=[N+](C)C2=C(S1)C=C(OC)C=C2.CCN(CCO)C1=CC=C(C=C1)N=NC1=[N+](C)C2=C(S1)C=C(OC)C=C2
InChIKey
InChIKey=KCNIDFGVWKPDPF-UHFFFAOYSA-L
Formula
C38H46N8O8S3
Mass
839.01
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Benzothiazoles
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzothiazoles
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Benzothiazoles
Alternative Parents
Aniline and substituted anilines Anisoles Dialkylarylamines Alkyl aryl ethers Organic sulfate salts Thiazoles Organic sulfuric acids and derivatives Heteroaromatic compounds 1,2-aminoalcohols Azo compounds Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Hydrocarbon derivatives Organic oxides Organopnictogen compounds Primary alcohols
Molecular Framework
Not available
Substituents
1,3-benzothiazole - Anisole - Tertiary aliphatic/aromatic amine - Dialkylarylamine - Aniline or substituted anilines - Alkyl aryl ether - Organic sulfate salt - Monocyclic benzene moiety - Benzenoid - Heteroaromatic compound - Azole - Organic sulfuric acid or derivatives - Thiazole - 1,2-aminoalcohol - Azo compound - Tertiary amine - Azacycle - Alkanolamine - Organic 1,3-dipolar compound - Ether - Propargyl-type 1,3-dipolar organic compound - Hydrocarbon derivative - Organic nitrogen compound - Organic oxide - Organic salt - Organopnictogen compound - Organic oxygen compound - Amine - Organonitrogen compound - Organooxygen compound - Primary alcohol - Alcohol - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as benzothiazoles. These are organic compounds containing a benzene fused to a thiazole ring (a five-membered ring with four carbon atoms, one nitrogen atom and one sulfur atom).
External Descriptors
Not available