Compound Identification
SMILES
O=C(NC1=NC2=C(N1)C=C(C=C2)C1=CC(=O)N=C(NCC2OCCO2)N1)C1=CC=CS1
InChIKey
InChIKey=MUVJULJYABACGA-UHFFFAOYSA-N
Formula
C20H18N6O4S
Mass
438.46
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
2-heteroaryl carboxamides Thiophene carboxamides Aminopyrimidines and derivatives Secondary alkylarylamines Pyrimidones Benzenoids Hydropyrimidines 1,3-dioxolanes Vinylogous amides Heteroaromatic compounds Imidazoles Secondary carboxylic acid amides Acetals Oxacyclic compounds Azacyclic compounds Hydrocarbon derivatives Organopnictogen compounds Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzimidazole - Thiophene carboxamide - Thiophene carboxylic acid or derivatives - 2-heteroaryl carboxamide - Secondary aliphatic/aromatic amine - Pyrimidone - Aminopyrimidine - Hydropyrimidine - Benzenoid - Pyrimidine - Heteroaromatic compound - Imidazole - Vinylogous amide - Thiophene - Azole - Meta-dioxolane - Carboxamide group - Secondary carboxylic acid amide - Acetal - Carboxylic acid derivative - Oxacycle - Azacycle - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organonitrogen compound - Organooxygen 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