Compound Identification
SMILES
COCC1=CC(C)=NC2=C1C1=N[C@H](N3C(NC4=CC=CC=C34)=C1S2)C1=CC=C(Br)O1
InChIKey
InChIKey=DVXFEUUCDYOCNS-HXUWFJFHSA-N
Formula
C22H17BrN4O2S
Mass
481.37
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Imidazopyrimidines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Imidazopyrimidines
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Imidazopyrimidines
Alternative Parents
Thienopyridines Benzimidazoles Methylpyridines Benzenoids Aryl bromides Thiophenes Heteroaromatic compounds Furans Oxacyclic compounds Dialkyl ethers Azacyclic compounds Organobromides Hydrocarbon derivatives Amines
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzimidazole - Imidazopyrimidine - Thienopyridine - Methylpyridine - Aryl bromide - Aryl halide - Benzenoid - Pyridine - Heteroaromatic compound - Furan - Thiophene - Dialkyl ether - Ether - Oxacycle - Azacycle - Organic oxygen compound - Organic nitrogen compound - Amine - Hydrocarbon derivative - Organohalogen compound - Organobromide - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as imidazopyrimidines. These are organic polycyclic compounds containing an imidazole ring fused to a pyrimidine ring. Imidazole is 5-membered ring consisting of three carbon atoms, and two nitrogen centers at the 1- and 3-positions. 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