Compound Identification
SMILES
COC1=CC=C(C=C1)[C@H]1N2NC(=NC2=NC(C)=C1C(=O)NC1=CC=CC=C1)C1=CC=C(Cl)C=C1
InChIKey
InChIKey=BIFSAIJLBJPWKD-HSZRJFAPSA-N
Formula
C26H22ClN5O2
Mass
471.95
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 Anisoles Phenoxy compounds Methoxybenzenes N-arylamides Alkyl aryl ethers Chlorobenzenes Aryl chlorides Hydropyrimidines Imidolactams Triazolines Secondary carboxylic acid amides Amidrazones Azacyclic compounds Propargyl-type 1,3-dipolar organic compounds Amidines Hydrocarbon derivatives Organochlorides Carbonyl compounds Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Pyrimidinecarboxamide - Triazolopyrimidine - Anilide - Phenoxy compound - Anisole - Phenol ether - N-arylamide - Methoxybenzene - Alkyl aryl ether - Halobenzene - Chlorobenzene - 1,6-dihydropyrimidine - Imidolactam - Benzenoid - Monocyclic benzene moiety - Aryl halide - Hydropyrimidine - Aryl chloride - Triazoline - Carboxylic acid amidrazone - Carboxamide group - Secondary carboxylic acid amide - Propargyl-type 1,3-dipolar organic compound - Ether - Organic 1,3-dipolar compound - Carboxylic acid derivative - Amidine - Azacycle - Organooxygen compound - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organohalogen compound - Organochloride - Organonitrogen compound - 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