Compound Identification
SMILES
CC1=C(CSC2=NC3=CC=CC=C3N2)C=CC=C1SCCOC1=NN2C(C=C1)=NC=C2[N+]([O-])=O
InChIKey
InChIKey=MOCUTOFGYGJRKG-UHFFFAOYSA-N
Formula
C23H20N6O3S2
Mass
492.57
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
Thiophenol ethers Nitroaromatic compounds Nitroimidazoles Toluenes Alkyl aryl ethers Alkylarylthioethers Pyridazines and derivatives N-substituted imidazoles Heteroaromatic compounds Sulfenyl compounds Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organic oxoazanium compounds Hydrocarbon derivatives Organic zwitterions Organic salts Organonitrogen compounds Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzimidazole - Aryl thioether - Nitroaromatic compound - Nitroimidazole - Thiophenol ether - Alkyl aryl ether - Alkylarylthioether - Toluene - Monocyclic benzene moiety - N-substituted imidazole - Pyridazine - Benzenoid - Azole - Heteroaromatic compound - Imidazole - Organic nitro compound - C-nitro compound - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Thioether - Organic 1,3-dipolar compound - Sulfenyl compound - Ether - Azacycle - Organic oxoazanium - Organic zwitterion - Organic salt - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organosulfur compound - 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