Compound Identification
SMILES
CC(C)C1=C(C=C(C=C1)C(=O)NC1=CC(Br)=C2CCNCC2=C1)C#N
InChIKey
InChIKey=GYUIKFMZQWOTOD-UHFFFAOYSA-N
Formula
C20H20BrN3O
Mass
398.304
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Tetrahydroisoquinolines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Tetrahydroisoquinolines
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Tetrahydroisoquinolines
Alternative Parents
Aromatic monoterpenoids Bicyclic monoterpenoids Phenylpropanes Benzamides Cumenes Benzonitriles Benzoyl derivatives Aralkylamines Aryl bromides Secondary carboxylic acid amides Amino acids and derivatives Nitriles Azacyclic compounds Dialkylamines Organooxygen compounds Organobromides Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
P-cymene - Aromatic monoterpenoid - Bicyclic monoterpenoid - Monoterpenoid - Tetrahydroisoquinoline - Benzamide - Benzoic acid or derivatives - Cumene - Phenylpropane - Benzonitrile - Benzoyl - Aralkylamine - Benzenoid - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Secondary carboxylic acid amide - Amino acid or derivatives - Carboxamide group - Secondary aliphatic amine - Nitrile - Carboxylic acid derivative - Secondary amine - Carbonitrile - Azacycle - Cyanide - Organobromide - Organohalogen compound - Organonitrogen compound - Amine - Organooxygen compound - Organic nitrogen compound - Organic oxygen compound - Hydrocarbon derivative - Organic oxide - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as tetrahydroisoquinolines. These are tetrahydrogenated isoquinoline derivatives.
External Descriptors
Not available