Compound Identification
SMILES
NC1=C(NCC2=C(OCC3=CC=CC=N3)C=CC(=C2)C2=CC3=C(C=CN3)C=C2)C=CC=N1
InChIKey
InChIKey=KMBPJSHPAXOXBT-UHFFFAOYSA-N
Formula
C26H23N5O
Mass
421.504
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
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Class
Indoles and derivatives
- Subclass Indoles
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Class
Indoles and derivatives
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Indoles and derivatives
Subclass
Indoles
Intermediate Tree Nodes
Not available
Direct Parent
Indoles
Alternative Parents
Phenylmethylamines Phenoxy compounds Phenol ethers Benzylamines Secondary alkylarylamines Aralkylamines Aminopyridines and derivatives Alkyl aryl ethers Imidolactams Pyrroles Heteroaromatic compounds Azacyclic compounds Primary amines Organopnictogen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Indole - Phenoxy compound - Benzylamine - Phenol ether - Phenylmethylamine - Alkyl aryl ether - Aminopyridine - Aralkylamine - Secondary aliphatic/aromatic amine - Monocyclic benzene moiety - Pyridine - Imidolactam - Benzenoid - Heteroaromatic compound - Pyrrole - Azacycle - Ether - Secondary amine - Amine - Primary amine - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organopnictogen compound - Organic nitrogen compound - Organic oxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as indoles. These are compounds containing an indole moiety, which consists of pyrrole ring fused to benzene to form 2,3-benzopyrrole.
External Descriptors
Not available