Compound Identification
SMILES
NC(=O)C1=CN(N=C1NC1=CC=C(C=C1)C(F)(F)F)[C@H]1CC[C@@H](C[C@@H]1C#N)N1CC2(COC2)C1
InChIKey
InChIKey=NAKJZHJLVKNWTB-LJHODMEESA-N
Formula
C23H25F3N6O2
Mass
474.488
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 Pyrazole-4-carboxamides Cyclohexylamines Imidolactams Vinylogous amides Heteroaromatic compounds Amino acids and derivatives Trialkylamines Azetidines Primary carboxylic acid amides Oxetanes Dialkyl ethers Azacyclic compounds Oxacyclic compounds Nitriles Alkyl fluorides Hydrocarbon derivatives Organic oxides Organofluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Trifluoromethylbenzene - Pyrazole-4-carboxamide - Aniline or substituted anilines - Cyclohexylamine - Imidolactam - Azole - Pyrazole - Vinylogous amide - Heteroaromatic compound - Amino acid or derivatives - Azetidine - Carboxamide group - Oxetane - Primary carboxylic acid amide - Tertiary amine - Tertiary aliphatic amine - Azacycle - Oxacycle - Organoheterocyclic compound - Carboxylic acid derivative - Dialkyl ether - Ether - Carbonitrile - Nitrile - Cyanide - Organohalogen compound - Organofluoride - Organonitrogen compound - Organic oxygen compound - Organooxygen compound - Amine - Alkyl halide - Organic nitrogen compound - Organic oxide - Hydrocarbon derivative - 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