Compound Identification
SMILES
COC1=CC=C(C=C1)N1C(=O)C2=C(N=C1SCC1=CC(=CC=C1)C(F)(F)F)C1=CC=CC=C1N2
InChIKey
InChIKey=GZZAFSINLMSZAH-UHFFFAOYSA-N
Formula
C25H18F3N3O2S
Mass
481.49
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
Pyrrolopyrimidines Methoxyanilines Indoles Phenoxy compounds Anisoles Methoxybenzenes Alkyl aryl ethers Pyrimidones Alkylarylthioethers Pyrroles Heteroaromatic compounds Lactams Sulfenyl compounds Azacyclic compounds Alkyl fluorides Organofluorides Organonitrogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Trifluoromethylbenzene - Indole - Indole or derivatives - Methoxyaniline - Pyrrolopyrimidine - Phenoxy compound - Aryl thioether - Anisole - Phenol ether - Methoxybenzene - Alkyl aryl ether - Alkylarylthioether - Pyrimidone - Pyrimidine - Heteroaromatic compound - Pyrrole - Lactam - Sulfenyl compound - Organoheterocyclic compound - Azacycle - Thioether - Ether - Organosulfur compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organic oxygen compound - Alkyl halide - Alkyl fluoride - 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