Compound Identification
SMILES
COC1=CC=C(SCCCC(=O)N(CC2=CC=CO2)C2=NC3=C(S2)C=C(F)C=C3)C=C1
InChIKey
InChIKey=WNZUMXSOTZKOAV-UHFFFAOYSA-N
Formula
C23H21FN2O3S2
Mass
456.55
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
Thiophenol ethers Phenoxy compounds Anisoles Methoxybenzenes Alkyl aryl ethers Alkylarylthioethers Aryl fluorides Thiazoles Tertiary carboxylic acid amides Heteroaromatic compounds Furans Tertiary amines Amino acids and derivatives Sulfenyl compounds Oxacyclic compounds Azacyclic compounds Organic oxides Hydrocarbon derivatives Organofluorides Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1,3-benzothiazole - Anisole - Phenoxy compound - Aryl thioether - Phenol ether - Thiophenol ether - Methoxybenzene - Alkyl aryl ether - Alkylarylthioether - Aryl fluoride - Aryl halide - Benzenoid - Monocyclic benzene moiety - Heteroaromatic compound - Azole - Furan - Tertiary carboxylic acid amide - Thiazole - Tertiary amine - Carboxamide group - Amino acid or derivatives - Thioether - Oxacycle - Azacycle - Sulfenyl compound - Ether - Carboxylic acid derivative - Hydrocarbon derivative - Organohalogen compound - Carbonyl group - Organic oxygen compound - Organofluoride - Organonitrogen compound - Amine - Organooxygen compound - Organosulfur compound - Organic nitrogen compound - Organic oxide - 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