Compound Identification
SMILES
CC(=NNC(=O)CN1C2=CC=CC=C2N=C1C(F)(F)F)C1=CC=C(Cl)S1
InChIKey
InChIKey=SIMBVKTXOXZMIQ-UHFFFAOYSA-N
Formula
C16H12ClF3N4OS
Mass
400.8
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
2,5-disubstituted thiophenes N-substituted imidazoles Benzenoids Aryl chlorides Heteroaromatic compounds Carboxylic acids and derivatives Azacyclic compounds Organonitrogen compounds Organofluorides Organochlorides Organic oxides Hydrocarbon derivatives Carbonyl compounds Alkyl fluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzimidazole - 2,5-disubstituted thiophene - Aryl chloride - Aryl halide - N-substituted imidazole - Benzenoid - Heteroaromatic compound - Thiophene - Azole - Imidazole - Azacycle - Carboxylic acid derivative - Organic oxide - Organochloride - Organohalogen compound - Organofluoride - Organonitrogen compound - Carbonyl group - Organic nitrogen compound - Organooxygen compound - Alkyl halide - Organic oxygen compound - Alkyl fluoride - Hydrocarbon derivative - 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