Compound Identification
SMILES
COC1=CC2=C(S\C(N2C)=C2/SC(=NC3=C(C)C=CC(C)=C3)N(C)C2=O)C=C1
InChIKey
InChIKey=FVVNAYVHUJJSLL-GQOJFKQTSA-N
Formula
C21H21N3O2S2
Mass
411.54
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
p-Xylenes Anisoles Aryl thioethers Alkyl aryl ethers Vinylogous thioesters Vinylogous amides Thiazolidines Thiazoles Isothioureas Carboxylic acids and derivatives Azacyclic compounds Propargyl-type 1,3-dipolar organic compounds Carbonyl compounds Organic oxides Amines Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzo-thiazole - 1,2-benzothiazole - 1,3-benzothiazole - Aryl thioether - Anisole - P-xylene - Xylene - Phenol ether - Alkyl aryl ether - Monocyclic benzene moiety - Vinylogous thioester - Benzenoid - Vinylogous amide - Thiazole - Thiazolidine - Isothiourea - Organic 1,3-dipolar compound - Ether - Carboxylic acid derivative - Azacycle - Propargyl-type 1,3-dipolar organic compound - Organooxygen compound - Organonitrogen compound - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Amine - Organic oxygen 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