Compound Identification
SMILES
CC1=CN=C(NCCCN2CCCC2=O)N=C1C(C#N)C1=C(Br)C=CC=N1
InChIKey
InChIKey=LFSQDVDBGXGGMK-UHFFFAOYSA-N
Formula
C19H21BrN6O
Mass
429.322
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Diazines
-
Subclass
Pyrimidines and pyrimidine derivatives
- Level 5 Aminopyrimidines and derivatives
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Subclass
Pyrimidines and pyrimidine derivatives
-
Class
Diazines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Diazines
Subclass
Pyrimidines and pyrimidine derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Aminopyrimidines and derivatives
Alternative Parents
Pyrrolidine-2-ones Pyridines and derivatives N-alkylpyrrolidines Aryl bromides Tertiary carboxylic acid amides Heteroaromatic compounds Lactams Nitriles Azacyclic compounds Organobromides Organic oxides Hydrocarbon derivatives Carbonyl compounds Amines
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Aminopyrimidine - Aryl bromide - Aryl halide - Pyridine - N-alkylpyrrolidine - 2-pyrrolidone - Pyrrolidone - Heteroaromatic compound - Tertiary carboxylic acid amide - Pyrrolidine - Carboxamide group - Lactam - Carboxylic acid derivative - Carbonitrile - Nitrile - Azacycle - Organohalogen compound - Organic nitrogen compound - Hydrocarbon derivative - Amine - Organic oxide - Carbonyl group - Cyanide - Organobromide - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as aminopyrimidines and derivatives. These are organic compounds containing an amino group attached to a pyrimidine ring. Pyrimidine is a 6-membered ring consisting of four carbon atoms and two nitrogen centers at the 1- and 3- ring positions.
External Descriptors
Not available