Compound Identification
SMILES
COC1=CC2=C(C=C1)N=C(S2)C1(O)C=CC(=O)C=C1
InChIKey
InChIKey=ALFSWPMDXJJJAR-UHFFFAOYSA-N
Formula
C14H11NO3S
Mass
273.31
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
Anisoles Alkyl aryl ethers Thiazoles Tertiary alcohols Heteroaromatic compounds Cyclic ketones Azacyclic compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1,3-benzothiazole - Anisole - Phenol ether - Alkyl aryl ether - Benzenoid - Azole - Tertiary alcohol - Thiazole - Heteroaromatic compound - Ketone - Cyclic ketone - Ether - Azacycle - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Carbonyl group - Organic nitrogen compound - Organic oxygen compound - 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