Compound Identification
SMILES
COC1=CC2=C(SN=C2C(=O)N[C@@H]2CN3CCC2CC3)C=C1
InChIKey
InChIKey=XIBDASVCLSAVOS-CYBMUJFWSA-N
Formula
C16H19N3O2S
Mass
317.41
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
Thiazolecarboxamides Quinuclidines Anisoles 2-heteroaryl carboxamides Alkyl aryl ethers Piperidines Heteroaromatic compounds Trialkylamines Secondary carboxylic acid amides Amino acids and derivatives Azacyclic compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1,2-benzothiazole - 2-heteroaryl carboxamide - Anisole - Phenol ether - Quinuclidine - Thiazolecarboxamide - Thiazolecarboxylic acid or derivatives - Alkyl aryl ether - Piperidine - Benzenoid - Heteroaromatic compound - Thiazole - Azole - Tertiary aliphatic amine - Tertiary amine - Secondary carboxylic acid amide - Amino acid or derivatives - Carboxamide group - Azacycle - Ether - Carboxylic acid derivative - Amine - Organonitrogen compound - Organic oxide - Organooxygen compound - Organic oxygen compound - Hydrocarbon derivative - Organic nitrogen compound - 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