Compound Identification
SMILES
CCOC(=O)C1=C(C)NC(C(=O)CSC2=NC3=CC=CC=C3N2CCC2=CC=CC=C2)=C1C
InChIKey
InChIKey=YVXRTPUBOLDAKV-UHFFFAOYSA-N
Formula
C26H27N3O3S
Mass
461.58
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
Pyrrole carboxylic acids and derivatives Aryl alkyl ketones Alkylarylthioethers Substituted pyrroles N-substituted imidazoles Benzene and substituted derivatives Vinylogous amides Heteroaromatic compounds Carboxylic acid esters Sulfenyl compounds Azacyclic compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzimidazole - Aryl thioether - Pyrrole-3-carboxylic acid or derivatives - Aryl ketone - Aryl alkyl ketone - Alkylarylthioether - Monocyclic benzene moiety - N-substituted imidazole - Substituted pyrrole - Benzenoid - Azole - Imidazole - Pyrrole - Heteroaromatic compound - Vinylogous amide - Ketone - Carboxylic acid ester - Thioether - Sulfenyl compound - Azacycle - Carboxylic acid derivative - Organic nitrogen compound - Hydrocarbon derivative - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic oxide - Organic oxygen 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