Compound Identification
SMILES
CCCC1=C(CNC2=CC=C(CC3=NNN=N3)C=C2)C=CC(C(C)=O)=C1O
InChIKey
InChIKey=ROKIOTZMRLYACP-UHFFFAOYSA-N
Formula
C20H23N5O2
Mass
365.437
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
-
Subclass
Phenylmethylamines
- Level 5 Phenylbenzamines
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Subclass
Phenylmethylamines
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Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Phenylmethylamines
Intermediate Tree Nodes
Not available
Direct Parent
Phenylbenzamines
Alternative Parents
Alkyl-phenylketones Acetophenones Phenylpropanes Aniline and substituted anilines Aryl alkyl ketones Benzoyl derivatives Benzylamines Phenylalkylamines 1-hydroxy-4-unsubstituted benzenoids Secondary alkylarylamines Tetrazoles Heteroaromatic compounds Vinylogous acids Azacyclic compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenylbenzamine - Alkyl-phenylketone - Acetophenone - Phenylketone - Phenylpropane - Benzoyl - Benzylamine - Phenylalkylamine - Aniline or substituted anilines - Aryl ketone - Aryl alkyl ketone - 1-hydroxy-4-unsubstituted benzenoid - Phenol - Secondary aliphatic/aromatic amine - Aralkylamine - Azole - Heteroaromatic compound - Tetrazole - Vinylogous acid - Ketone - Azacycle - Secondary amine - Organoheterocyclic compound - Amine - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as phenylbenzamines. These are aromatic compounds consisting of a benzyl group that is N-linked to a benzamine.
External Descriptors
Not available