Compound Identification
SMILES
COC1=NC=C(C=C1)C1=C(C=NN2OCN(CC3=CN=C(C=C3)C(F)(F)F)N=C12)C1=CC=C(C)C=C1
InChIKey
InChIKey=SLTBOPHVJHJLST-UHFFFAOYSA-N
Formula
C25H21F3N6O2
Mass
494.478
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Toluenes
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Toluenes
Intermediate Tree Nodes
Not available
Direct Parent
Toluenes
Alternative Parents
Alkyl aryl ethers Pyridines and derivatives Pyridazines and derivatives Imidolactams Heteroaromatic compounds Amidrazones Oxacyclic compounds Hydrazones Azacyclic compounds Amidines Organofluorides Hydrocarbon derivatives Alkyl fluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alkyl aryl ether - Toluene - Imidolactam - Pyridine - Pyridazine - Heteroaromatic compound - Carboxylic acid amidrazone - Amidine - Oxacycle - Azacycle - Organoheterocyclic compound - Ether - Hydrazone - Organic nitrogen compound - Organofluoride - Organohalogen compound - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxygen compound - Alkyl halide - Alkyl fluoride - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as toluenes. These are compounds containing a benzene ring which bears a methane group.
External Descriptors
Not available