Compound Identification
SMILES
CC1=CC=CC=C1NC(=O)C1=C(C)N=C2N=C(NN2C1C1=CN=CC=C1)C1=CC=CC=C1Cl
InChIKey
InChIKey=XWZAFBPRSOTKIF-UHFFFAOYSA-N
Formula
C25H21ClN6O
Mass
456.93
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Triazolopyrimidines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Triazolopyrimidines
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Triazolopyrimidines
Alternative Parents
Anilides Pyrimidinecarboxamides N-arylamides Toluenes Chlorobenzenes Aryl chlorides Hydropyrimidines Imidolactams Pyridines and derivatives Triazolines Heteroaromatic compounds Amidrazones Secondary carboxylic acid amides Azacyclic compounds Amidines Propargyl-type 1,3-dipolar organic compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides Organochlorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Pyrimidinecarboxamide - Triazolopyrimidine - Anilide - N-arylamide - Toluene - Halobenzene - Chlorobenzene - Aryl halide - Imidolactam - Pyridine - Hydropyrimidine - Benzenoid - Aryl chloride - 1,6-dihydropyrimidine - Monocyclic benzene moiety - Triazoline - Heteroaromatic compound - Secondary carboxylic acid amide - Carboxylic acid amidrazone - Carboxamide group - Amidine - Azacycle - Carboxylic acid derivative - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organonitrogen compound - Organohalogen compound - Organochloride - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as triazolopyrimidines. These are polycyclic aromatic compounds containing triazole ring fused to a pyrimidine ring. Triazole is a five-membered ring consisting of two carbon atoms and three nitrogen atoms. 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