Compound Identification
SMILES
COC(=O)C1=C(CC(C)C)C(C(S)C2=NC3=C(N2)C=C(C=C3)[N+]([O-])=O)=C(N=C1C(F)F)C(F)(F)F
InChIKey
InChIKey=HSDKVWCSNODSNO-UHFFFAOYSA-N
Formula
C21H19F5N4O4S
Mass
518.46
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
Pyridinecarboxylic acids Nitroaromatic compounds Benzenoids Heteroaromatic compounds Imidazoles Methyl esters Propargyl-type 1,3-dipolar organic compounds Alkylthiols Azacyclic compounds Organic oxoazanium compounds Organic oxides Organic salts Hydrocarbon derivatives Organic zwitterions Organofluorides Organonitrogen compounds Organooxygen compounds Alkyl fluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzimidazole - Pyridine carboxylic acid - Pyridine carboxylic acid or derivatives - Nitroaromatic compound - Pyridine - Benzenoid - Azole - Imidazole - Methyl ester - Heteroaromatic compound - Organic nitro compound - Carboxylic acid ester - C-nitro compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Azacycle - Alkylthiol - Organic 1,3-dipolar compound - Carboxylic acid derivative - Organic oxoazanium - Organic zwitterion - Organonitrogen compound - Organofluoride - Organooxygen compound - Organohalogen compound - Organosulfur compound - Alkyl halide - Organic oxygen compound - Organic oxide - Organic nitrogen compound - Alkyl fluoride - Hydrocarbon derivative - Organic salt - 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