Compound Identification
SMILES
COC1=CC2=C(C=C1)N1C(S2)=NC(NC1=O)(C1=CC=C(C)C=C1)C(F)(F)F
InChIKey
InChIKey=KIEBVYWZYGYIFV-UHFFFAOYSA-N
Formula
C18H14F3N3O2S
Mass
393.38
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
Anisoles Aryl thioethers Triazinones Toluenes Alkyl aryl ethers 1,3,5-triazines Thiazoles Ureas Isothioureas Azacyclic compounds Propargyl-type 1,3-dipolar organic compounds Hydrocarbon derivatives Carbonyl compounds Organofluorides Organonitrogen compounds Alkyl fluorides Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzo-thiazole - 1,2-benzothiazole - 1,3-benzothiazole - Anisole - Aryl thioether - Phenol ether - Triazinone - Toluene - Alkyl aryl ether - 1,3,5-triazine - Benzenoid - Triazine - Monocyclic benzene moiety - Thiazole - Urea - Isothiourea - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Azacycle - Ether - Organic oxide - Organohalogen compound - Organofluoride - Carbonyl group - Organic oxygen compound - Alkyl fluoride - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Alkyl halide - Hydrocarbon derivative - 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