Compound Identification
SMILES
FC1=CC2=C(C=C1)N=C(NC(=O)C1=CSC(=N1)C1CCN(CC1)C(=O)C1=C(SCC=C)N=CC=C1)S2
InChIKey
InChIKey=UQSGJMLVCQRDMD-UHFFFAOYSA-N
Formula
C25H22FN5O2S3
Mass
539.66
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
Pyridinecarboxylic acids and derivatives N-acylpiperidines Thiazolecarboxamides 2-heteroaryl carboxamides 2,4-disubstituted thiazoles Alkylarylthioethers Vinylogous thioesters Aryl fluorides Benzenoids Tertiary carboxylic acid amides Heteroaromatic compounds Secondary carboxylic acid amides Allyl sulfur compounds Sulfenyl compounds Azacyclic compounds Organic oxides Organofluorides Organonitrogen compounds Organooxygen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Pyridine carboxylic acid or derivatives - N-acyl-piperidine - 1,3-benzothiazole - 2-heteroaryl carboxamide - Aryl thioether - Thiazolecarboxamide - Thiazolecarboxylic acid or derivatives - 2,4-disubstituted 1,3-thiazole - Alkylarylthioether - Vinylogous thioester - Piperidine - Benzenoid - Aryl halide - Aryl fluoride - Pyridine - Thiazole - Tertiary carboxylic acid amide - Azole - Heteroaromatic compound - Carboxamide group - Allyl sulfur compound - Secondary carboxylic acid amide - Azacycle - Sulfenyl compound - Carboxylic acid derivative - Thioether - Organohalogen compound - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organofluoride - Organonitrogen 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