Compound Identification
SMILES
[Cl-].[Cl-].[Co+3].CCO.NCCNCC1=NC=C(Br)C(=N1)C([O-])=NCCC1=CN=CN1
InChIKey
InChIKey=QGMJAKLVDZYEMR-UHFFFAOYSA-K
Formula
C15H23BrCl2CoN7O2
Mass
543.13
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Diazines
-
Subclass
Pyrimidines and pyrimidine derivatives
- Level 5 Halopyrimidines
-
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
Halopyrimidines
Alternative Parents
Aralkylamines Aryl bromides Imidazoles Heteroaromatic compounds Propargyl-type 1,3-dipolar organic compounds Organic metal halides Dialkylamines Carboximidic acids Azacyclic compounds Primary alcohols Organopnictogen compounds Organobromides Organic zwitterions Organic oxides Organic cobalt salts Organic chloride salts Monoalkylamines Hydrocarbon derivatives
Molecular Framework
Not available
Substituents
Aralkylamine - Halopyrimidine - Aryl halide - Aryl bromide - Heteroaromatic compound - Imidazole - Azole - Organic metal halide - Azacycle - Organic transition metal salt - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Secondary amine - Secondary aliphatic amine - Carboximidic acid derivative - Carboximidic acid - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organic cobalt salt - Organic chloride salt - Organic salt - Organic zwitterion - Primary amine - Primary alcohol - Organooxygen compound - Organonitrogen compound - Organobromide - Organohalogen compound - Primary aliphatic amine - Amine - Alcohol - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as halopyrimidines. These are aromatic compounds containing a halogen atom linked 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