Compound Identification
SMILES
CC1=CC(=O)N2C(NC3=C2C=CC(=C3)[N+]([O-])=O)S1
InChIKey
InChIKey=YOJZQSOSVIZALM-UHFFFAOYSA-N
Formula
C11H9N3O3S
Mass
263.27
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
Nitroaromatic compounds Vinylogous thioesters 1,3-thiazines Benzenoids Tertiary carboxylic acid amides Thioenol ethers Lactams Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organic oxoazanium compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides Organic salts Amines Organic zwitterions
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzimidazole - Nitroaromatic compound - Meta-thiazine - Benzenoid - Vinylogous thioester - Tertiary carboxylic acid amide - Carboxamide group - Lactam - C-nitro compound - Thioenolether - Organic nitro compound - Allyl-type 1,3-dipolar organic compound - Azacycle - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Carboxylic acid derivative - Organic oxoazanium - Carbonyl group - Organonitrogen compound - Organooxygen compound - Amine - Organic oxide - Organic nitrogen compound - Organic oxygen compound - Organic zwitterion - Organic salt - 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