Compound Identification
SMILES
N[C@@H]1CCCN(C1)C1=NC=C(Br)C(=O)N1CC1=CC=CC=C1C#N
InChIKey
InChIKey=GGCILSXUAHLDMF-CQSZACIVSA-N
Formula
C17H18BrN5O
Mass
388.269
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Benzonitriles
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Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Benzonitriles
Intermediate Tree Nodes
Not available
Direct Parent
Benzonitriles
Alternative Parents
Dialkylarylamines Pyrimidones Aminopiperidines Aminopyrimidines and derivatives Halopyrimidines Aryl bromides Hydropyrimidines Heteroaromatic compounds Lactams Azacyclic compounds Nitriles Organooxygen compounds Hydrocarbon derivatives Organic oxides Organobromides Organopnictogen compounds Monoalkylamines
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Benzonitrile - Dialkylarylamine - 3-aminopiperidine - Aminopyrimidine - Halopyrimidine - Pyrimidone - Aryl bromide - Pyrimidine - Aryl halide - Piperidine - Hydropyrimidine - Heteroaromatic compound - Lactam - Azacycle - Organoheterocyclic compound - Carbonitrile - Nitrile - Organopnictogen compound - Organohalogen compound - Organobromide - Primary aliphatic amine - Organonitrogen compound - Organooxygen compound - Amine - Organic nitrogen compound - Primary amine - Organic oxygen compound - Hydrocarbon derivative - Organic oxide - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as benzonitriles. These are organic compounds containing a benzene bearing a nitrile substituent.
External Descriptors
Not available