Compound Identification
SMILES
CCCCCCCCCCCCCCCC1=C(C2C(C(=O)OC)=C(C)NC(CN3C(=S)NC4=CC=CC=C34)=C2C(=O)OC)C(OC)=CC=C1
InChIKey
InChIKey=BMFWZQRHJJQBGI-UHFFFAOYSA-N
Formula
C40H55N3O5S
Mass
689.96
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
Dihydropyridinecarboxylic acids and derivatives Anisoles Phenoxy compounds Methoxybenzenes Alkyl aryl ethers Dicarboxylic acids and derivatives N-substituted imidazoles Imidazolethiones Vinylogous amides Methyl esters Enoate esters Heteroaromatic compounds Thioureas Dialkylamines Enamines Azacyclic compounds Organic oxides Carbonyl compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzimidazole - Dihydropyridinecarboxylic acid derivative - Phenoxy compound - Anisole - Phenol ether - Methoxybenzene - Alkyl aryl ether - Dihydropyridine - Monocyclic benzene moiety - Dicarboxylic acid or derivatives - Hydropyridine - Imidazole-2-thione - N-substituted imidazole - Benzenoid - Vinylogous amide - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Azole - Methyl ester - Imidazole - Heteroaromatic compound - Thiourea - Carboxylic acid ester - Azacycle - Ether - Enamine - Carboxylic acid derivative - Secondary aliphatic amine - Organosulfur compound - Amine - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Organic nitrogen 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