Compound Identification
SMILES
COC1=C(OC)C=C(CC2=NC(=O)C3=NNN(C(CCCC4=CC=CC=C4)C(C)O)C3=N2)C=C1
InChIKey
InChIKey=KUVLMJNEVNJZJU-UHFFFAOYSA-N
Formula
C25H29N5O4
Mass
463.538
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
Dimethoxybenzenes Triazolopyrimidines Phenoxy compounds Anisoles Pyrimidones Alkyl aryl ethers Vinylogous amides Triazoles Heteroaromatic compounds Secondary alcohols Azacyclic compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenylbutylamine - Dimethoxybenzene - O-dimethoxybenzene - Triazolopyrimidine - Phenol ether - Anisole - Methoxybenzene - Phenoxy compound - Alkyl aryl ether - Pyrimidone - Pyrimidine - Heteroaromatic compound - Vinylogous amide - 1,2,3-triazole - Triazole - Azole - Secondary alcohol - Ether - Azacycle - Organoheterocyclic compound - Organooxygen compound - Organonitrogen compound - Alcohol - Organic oxide - Hydrocarbon derivative - Organic nitrogen compound - Organic oxygen compound - Aromatic heteropolycyclic 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