Compound Identification
SMILES
COC1=CC2=C(SC(N2C2=CC=CC=C2)=C2SC(=S)N(C)C2=O)C=C1
InChIKey
InChIKey=XOWJNUIFVKQRMJ-UHFFFAOYSA-N
Formula
C18H14N2O2S3
Mass
386.5
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
Aryl thioethers Anisoles Aniline and substituted anilines Alkyl aryl ethers Vinylogous thioesters Thiazolidinethiones Vinylogous amides Thiazoles Cyclic dithiocarbamic acid esters Carboxylic acids and derivatives Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds Amines
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzo-thiazole - 1,2-benzothiazole - 1,3-benzothiazole - Anisole - Aryl thioether - Phenol ether - Aniline or substituted anilines - Alkyl aryl ether - Monocyclic benzene moiety - Thiazolidinethione - Benzenoid - Vinylogous thioester - Dithiocarbamic acid ester - Thiazolidine - Thiazole - Vinylogous amide - Cyclic dithiocarbamic acid ester - Azacycle - Carboxylic acid derivative - Ether - Amine - Organonitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organooxygen compound - Organosulfur 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