Compound Identification
SMILES
OCCOC1=CC=CC(CN[C@H]2CCCN(C2)C2=NC3=CC=CC=C3S2)=C1
InChIKey
InChIKey=QHXRYVLTQSSXNP-KRWDZBQOSA-N
Formula
C21H25N3O2S
Mass
383.51
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
Phenylmethylamines Phenoxy compounds Phenol ethers Dialkylarylamines Benzylamines Aralkylamines Aminopiperidines Alkyl aryl ethers 2-amino-1,3-thiazoles Heteroaromatic compounds Dialkylamines Azacyclic compounds Primary alcohols Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1,3-benzothiazole - Benzylamine - Phenol ether - Phenylmethylamine - Dialkylarylamine - Phenoxy compound - 3-aminopiperidine - Aralkylamine - Alkyl aryl ether - 1,3-thiazol-2-amine - Benzenoid - Piperidine - Monocyclic benzene moiety - Thiazole - Heteroaromatic compound - Azole - Secondary amine - Azacycle - Ether - Secondary aliphatic amine - Organic oxygen compound - Alcohol - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Amine - Primary alcohol - Hydrocarbon derivative - 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