Compound Identification
SMILES
[K+].[O-]C1=NC(=O)\C(S1)=C\C(=O)NC1=NC=C(CC2=CC(=CC=C2)C(F)(F)F)S1
InChIKey
InChIKey=NTIOQAYHCSLSCL-AVHZNCSWSA-M
Formula
C16H9F3KN3O3S2
Mass
451.48
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Trifluoromethylbenzenes
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Trifluoromethylbenzenes
Intermediate Tree Nodes
Not available
Direct Parent
Trifluoromethylbenzenes
Alternative Parents
N-arylamides 2,5-disubstituted thiazoles Thiazolines Heteroaromatic compounds Secondary carboxylic acid amides N-acylimines Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organic metal halides Organic zwitterions Hydrocarbon derivatives Organofluorides Carbonyl compounds Organic potassium salts Alkyl fluorides Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Trifluoromethylbenzene - N-arylamide - 2,5-disubstituted 1,3-thiazole - Azole - Thiazole - Heteroaromatic compound - Meta-thiazoline - Carboxamide group - Secondary carboxylic acid amide - N-acylimine - Organic metal halide - Carboxylic acid derivative - Azacycle - Organic alkali metal salt - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organoheterocyclic compound - Alkyl halide - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Alkyl fluoride - Organic potassium salt - Organic zwitterion - Organic oxygen compound - Carbonyl group - Organic salt - Organic nitrogen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as trifluoromethylbenzenes. These are organofluorine compounds that contain a benzene ring substituted with one or more trifluoromethyl groups.
External Descriptors
Not available