Compound Identification
SMILES
Cl.CCN(CC)CCN(C(=O)C1=CC=C(Br)O1)C1=NC2=C(OC)C=CC(Cl)=C2S1
InChIKey
InChIKey=XYHJKHVGTZKYGS-UHFFFAOYSA-N
Formula
C19H22BrCl2N3O3S
Mass
523.27
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
2-heteroaryl carboxamides Anisoles Furoic acid and derivatives Alkyl aryl ethers Aryl bromides Aryl chlorides Thiazoles Tertiary carboxylic acid amides Heteroaromatic compounds Trialkylamines Amino acids and derivatives Oxacyclic compounds Azacyclic compounds Hydrocarbon derivatives Hydrochlorides Organic oxides Organobromides Organochlorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1,3-benzothiazole - 2-heteroaryl carboxamide - Furoic acid or derivatives - Anisole - Phenol ether - Alkyl aryl ether - Aryl bromide - Aryl halide - Benzenoid - Aryl chloride - Furan - Azole - Heteroaromatic compound - Tertiary carboxylic acid amide - Thiazole - Tertiary amine - Carboxamide group - Amino acid or derivatives - Tertiary aliphatic amine - Oxacycle - Carboxylic acid derivative - Ether - Azacycle - Organic nitrogen compound - Organohalogen compound - Organobromide - Organochloride - Organonitrogen compound - Organooxygen compound - Hydrochloride - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Amine - 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