Compound Identification
SMILES
CC(O)(CCN1C(CN2N=C(C3=C2C=NC=C3)S(C)(=O)=O)=NC2=C1C=CC(Cl)=C2)C(F)(F)F
InChIKey
InChIKey=YIJCJJSAIJFHQP-UHFFFAOYSA-N
Formula
C20H19ClF3N5O3S
Mass
501.91
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Benzimidazoles
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzimidazoles
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Benzimidazoles
Alternative Parents
Pyridines and derivatives Aryl chlorides Benzenoids N-substituted imidazoles Tertiary alcohols Sulfones Pyrazoles Heteroaromatic compounds Fluorohydrins Azacyclic compounds Hydrocarbon derivatives Organochlorides Alkyl fluorides Organofluorides Organonitrogen compounds Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzimidazole - Aryl chloride - Aryl halide - N-substituted imidazole - Pyridine - Benzenoid - Azole - Imidazole - Pyrazole - Heteroaromatic compound - Sulfone - Sulfonyl - Tertiary alcohol - Fluorohydrin - Halohydrin - Azacycle - Organooxygen compound - Organochloride - Organohalogen compound - Hydrocarbon derivative - Alkyl fluoride - Organofluoride - Organonitrogen compound - Organic oxide - Organosulfur compound - Alkyl halide - Organic nitrogen compound - Organic oxygen compound - Alcohol - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as benzimidazoles. These are organic compounds containing a benzene ring fused to an imidazole ring (five member ring containing a nitrogen atom, 4 carbon atoms, and two double bonds).
External Descriptors
Not available