Compound Identification
SMILES
CC(C)C1=CC=C(C=C1)C1=C[C@@H](N2C(NC3=CC=CC=C23)=N1)C1=C(F)C=CC=C1Cl
InChIKey
InChIKey=YWKRHZMOJWBSGM-HSZRJFAPSA-N
Formula
C25H21ClFN3
Mass
417.91
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Prenol lipids
-
Subclass
Monoterpenoids
- Level 5 Aromatic monoterpenoids
-
Subclass
Monoterpenoids
-
Class
Prenol lipids
-
Superclass
Lipids and lipid-like molecules
Kingdom
Organic compounds
Superclass
Lipids and lipid-like molecules
Class
Prenol lipids
Subclass
Monoterpenoids
Intermediate Tree Nodes
Not available
Direct Parent
Aromatic monoterpenoids
Alternative Parents
Phenylpropanes Cumenes Benzimidazoles Fluorobenzenes Chlorobenzenes Hydropyrimidines Aryl fluorides Aryl chlorides Guanidines Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organofluorides Organochlorides Hydrocarbon derivatives Amines
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
P-cymene - Aromatic monoterpenoid - Benzimidazole - Cumene - Phenylpropane - Chlorobenzene - Fluorobenzene - Halobenzene - Aryl chloride - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Hydropyrimidine - 1,6-dihydropyrimidine - Guanidine - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organoheterocyclic compound - Azacycle - Hydrocarbon derivative - Amine - Organic nitrogen compound - Organohalogen compound - Organochloride - Organofluoride - Organonitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as aromatic monoterpenoids. These are monoterpenoids containing at least one aromatic ring.
External Descriptors
Not available