Compound Identification
SMILES
COCCN1C(SC2=C1C=CC(OC)=C2)=NC(=O)C1=CC(=CC=C1)S(C)(=O)=O
InChIKey
InChIKey=PCSAPNHWRHHHNY-UHFFFAOYSA-N
Formula
C19H20N2O5S2
Mass
420.5
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
Benzoic acids and derivatives Benzenesulfonyl compounds Benzoyl derivatives Anisoles Alkyl aryl ethers Thiazoles Sulfones Heteroaromatic compounds Isothioureas Dialkyl ethers Carboxylic acids and derivatives Azacyclic compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzoic acid or derivatives - Benzenesulfonyl group - 1,3-benzothiazole - Anisole - Benzoyl - Phenol ether - Alkyl aryl ether - Monocyclic benzene moiety - Benzenoid - Sulfonyl - Sulfone - Thiazole - Azole - Heteroaromatic compound - Isothiourea - Azacycle - Ether - Dialkyl ether - Carboxylic acid derivative - Organic oxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - 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