Compound Identification
SMILES
CN(CCCNCC1=CC=C(C=C1)C(F)(F)F)C1=NC(=NS1)N1C=CN=C1
InChIKey
InChIKey=PDLHRMAEMZCQPL-UHFFFAOYSA-N
Formula
C17H19F3N6S
Mass
396.44
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
Phenylmethylamines Dialkylarylamines Benzylamines Aralkylamines N-substituted imidazoles Thiadiazoles Heteroaromatic compounds Dialkylamines Azacyclic compounds Organofluorides Hydrocarbon derivatives Alkyl fluorides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Trifluoromethylbenzene - Benzylamine - Phenylmethylamine - Dialkylarylamine - Aralkylamine - N-substituted imidazole - Heteroaromatic compound - Azole - Imidazole - Thiadiazole - Azacycle - Secondary aliphatic amine - Organoheterocyclic compound - Secondary amine - Amine - Alkyl halide - Organic nitrogen compound - Alkyl fluoride - Organohalogen compound - Organofluoride - Organonitrogen compound - Hydrocarbon derivative - 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