Compound Identification
SMILES
CC1=CC2=C(C=C1C)N=C(NC1=NC(NC3CCC(O)CC3)=NC(CC3=CC=CC=C3)=C1)S2
InChIKey
InChIKey=ADLGFXXJNWPIRR-UHFFFAOYSA-N
Formula
C26H29N5OS
Mass
459.61
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
Secondary alkylarylamines Cyclohexanols Aminopyrimidines and derivatives Imidolactams Benzene and substituted derivatives 2-amino-1,3-thiazoles Heteroaromatic compounds Cyclic alcohols and derivatives Azacyclic compounds Organopnictogen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1,3-benzothiazole - Secondary aliphatic/aromatic amine - Cyclohexanol - Aminopyrimidine - 1,3-thiazol-2-amine - Imidolactam - Benzenoid - Pyrimidine - Monocyclic benzene moiety - Heteroaromatic compound - Thiazole - Cyclic alcohol - Azole - Secondary alcohol - Azacycle - Secondary amine - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Amine - 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