Compound Identification
SMILES
NC(CC(N)=O)CC1=CC=C(CCCCN=C(N)NC(=O)C2=C(N)N=C(N)C(Cl)=N2)C=C1
InChIKey
InChIKey=MOENGRSDDQEFEF-UHFFFAOYSA-N
Formula
C20H28ClN9O2
Mass
461.96
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Phenylbutylamines
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Phenylbutylamines
Intermediate Tree Nodes
Not available
Direct Parent
Phenylbutylamines
Alternative Parents
Beta amino acids and derivatives Amphetamines and derivatives Pyrazinecarboxamides Aminopyrazines Aralkylamines Aryl chlorides Fatty amides Imidolactams Vinylogous amides Heteroaromatic compounds Guanidines Primary carboxylic acid amides Propargyl-type 1,3-dipolar organic compounds Carboximidamides Azacyclic compounds Organic oxides Carbonyl compounds Organochlorides Organopnictogen compounds Hydrocarbon derivatives Monoalkylamines
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Beta amino acid or derivatives - Phenylbutylamine - Amphetamine or derivatives - Pyrazine carboxylic acid or derivatives - Pyrazinecarboxamide - Aminopyrazine - Aralkylamine - Aryl chloride - Aryl halide - Fatty amide - Fatty acyl - Imidolactam - Pyrazine - Heteroaromatic compound - Vinylogous amide - Amino acid or derivatives - Carboxamide group - Guanidine - Primary carboxylic acid amide - Carboximidamide - Organoheterocyclic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Carboxylic acid derivative - Azacycle - Primary amine - Primary aliphatic amine - Organic nitrogen compound - Organohalogen compound - Organochloride - Amine - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as phenylbutylamines. These are compounds containing a phenylbutylamine moiety, which consists of a phenyl group substituted at the fourth carbon by an butan-1-amine.
External Descriptors
Not available