Compound Identification
SMILES
NC1=CC=C(C[C@@H]2[C@H](O)[C@@H](O)[C@@H](CC3=CC=C(N)C=C3)N(CC3=CC=CC(=C3)C(=O)NC3=NC4=CC=CC=C4N3)C(=O)N2CC2=CC=CC(=C2)C(=O)NC2=NC3=CC=CC=C3N2)C=C1
InChIKey
InChIKey=HGYTWPINTWNYHN-QHQGJXSCSA-N
Formula
C49H46N10O5
Mass
854.972
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
Benzamides Aniline and substituted anilines Benzoyl derivatives 1,3-diazepanes Imidazoles Heteroaromatic compounds Ureas Secondary carboxylic acid amides Secondary alcohols 1,2-diols Amino acids and derivatives Azacyclic compounds Primary amines Hydrocarbon derivatives Organic oxides Organopnictogen compounds Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzamide - Benzimidazole - Benzoic acid or derivatives - Benzoyl - Aniline or substituted anilines - 1,3-diazepane - Diazepane - Monocyclic benzene moiety - Benzenoid - Azole - Imidazole - Heteroaromatic compound - Urea - Secondary carboxylic acid amide - Secondary alcohol - Amino acid or derivatives - Carbonic acid derivative - Carboxamide group - 1,2-diol - Azacycle - Carboxylic acid derivative - Primary amine - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Carbonyl group - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Amine - Alcohol - 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