Compound Identification
SMILES
CCOC(=O)C1=C(NC(=O)CSCC(=O)N=C2SC3=C(C=CC(=C3)C(=O)OCC)N2C)SC2=C1CCC(C)C2
InChIKey
InChIKey=RRMSWQNZNSKLCU-UHFFFAOYSA-N
Formula
C27H31N3O6S3
Mass
589.74
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 carboxylic acids and derivatives N-arylamides Benzenoids Vinylogous amides Thiazoles Heteroaromatic compounds Secondary carboxylic acid amides Carboxylic acid esters N-acylimines Isothioureas Azacyclic compounds Sulfenyl compounds Dialkylthioethers Organic oxides Carbonyl compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1,3-benzothiazole - Thiophene carboxylic acid or derivatives - N-arylamide - Benzenoid - Azole - Thiazole - Thiophene - Vinylogous amide - Heteroaromatic compound - Carboxamide group - N-acylimine - Secondary carboxylic acid amide - Carboxylic acid ester - Isothiourea - Sulfenyl compound - Azacycle - Dialkylthioether - Thioether - Carboxylic acid derivative - Organic oxide - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Hydrocarbon derivative - Organic oxygen compound - Carbonyl group - Organic nitrogen 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