Compound Identification
SMILES
COC(=O)CCN1C(SC2=C1C=C(OC)C=C2)=NC(=O)C1=CC=C(Cl)S1
InChIKey
InChIKey=YMERSTQCPQDOFZ-UHFFFAOYSA-N
Formula
C17H15ClN2O4S2
Mass
410.89
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
Thiophene carboxamides Anisoles 2,5-disubstituted thiophenes Alkyl aryl ethers Aryl chlorides Thiazoles Methyl esters Heteroaromatic compounds Isothioureas Monocarboxylic acids and derivatives Azacyclic compounds Organochlorides Organonitrogen compounds Organic oxides Carbonyl compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1,3-benzothiazole - Phenol ether - Thiophene carboxamide - Thiophene carboxylic acid or derivatives - Anisole - 2,5-disubstituted thiophene - Alkyl aryl ether - Benzenoid - Aryl halide - Aryl chloride - Methyl ester - Thiophene - Thiazole - Azole - Heteroaromatic compound - Isothiourea - Carboxylic acid ester - Azacycle - Monocarboxylic acid or derivatives - Ether - Carboxylic acid derivative - Organic nitrogen compound - Organohalogen compound - Organochloride - Carbonyl group - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - 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