Compound Identification
SMILES
CCN(CC1CCCC1)C1=C(CNC2=NC=C(OCCS(C)=O)C=N2)N(CC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F)C(OC)C=C1
InChIKey
InChIKey=VJXMAEFOHFEKBD-UHFFFAOYSA-N
Formula
C31H39F6N5O3S
Mass
675.74
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
Dihydropyridines Aminopyrimidines and derivatives Alkyl aryl ethers Heteroaromatic compounds Trialkylamines Sulfoxides Sulfinyl compounds Enamines Azacyclic compounds Organofluorides Organic oxides Hydrocarbon derivatives Alkyl fluorides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Trifluoromethylbenzene - Alkyl aryl ether - Aminopyrimidine - Dihydropyridine - Hydropyridine - Pyrimidine - Heteroaromatic compound - Sulfoxide - Tertiary amine - Tertiary aliphatic amine - Enamine - Ether - Azacycle - Organoheterocyclic compound - Sulfinyl compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Hydrocarbon derivative - Alkyl fluoride - Organic nitrogen compound - Organic oxide - Organooxygen compound - Organosulfur compound - Alkyl halide - Amine - Organic oxygen 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