Compound Identification
SMILES
[O-]C1=CC(=O)C2=C(N1)N=C(NC1=CC=CC(=C1)C(F)(F)F)S2
InChIKey
InChIKey=JMFKJLOBBFTGOF-UHFFFAOYSA-M
Formula
C13H7F3N3O2S
Mass
326.27
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
Aniline and substituted anilines Pyridinolates 2-amino-1,3-thiazoles Vinylogous amides Vinylogous acids Heteroaromatic compounds Secondary amines Azacyclic compounds Organooxygen compounds Organofluorides Organic oxides Hydrocarbon derivatives Alkyl fluorides Organic anions
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Trifluoromethylbenzene - Aniline or substituted anilines - Pyridinolate - Pyridine - 1,3-thiazol-2-amine - Azole - Thiazole - Vinylogous acid - Vinylogous amide - Heteroaromatic compound - Organoheterocyclic compound - Secondary amine - Azacycle - Amine - Alkyl halide - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Organic oxygen compound - Organic oxide - Alkyl fluoride - Hydrocarbon derivative - Organic anion - Aromatic heteropolycyclic 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