Compound Identification
SMILES
CC1=C(C(N2NC(=NC2=N1)C1=CC=CC=C1Cl)C1=CC(=CC=C1)[N+]([O-])=O)C(N)=O
InChIKey
InChIKey=QAKWKRDJZDSCMU-UHFFFAOYSA-N
Formula
C19H15ClN6O3
Mass
410.82
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
Pyrimidinecarboxamides Nitrobenzenes Nitroaromatic compounds Chlorobenzenes Imidolactams Hydropyrimidines Aryl chlorides Triazolines Amidrazones Primary carboxylic acid amides Organic oxoazanium compounds Propargyl-type 1,3-dipolar organic compounds Amidines Azacyclic compounds Organochlorides Organic zwitterions Organic salts Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Pyrimidinecarboxamide - Triazolopyrimidine - Nitrobenzene - Nitroaromatic compound - Chlorobenzene - Halobenzene - 1,6-dihydropyrimidine - Benzenoid - Aryl chloride - Hydropyrimidine - Aryl halide - Monocyclic benzene moiety - Imidolactam - Triazoline - Carboxamide group - Primary carboxylic acid amide - Carboxylic acid amidrazone - Organic nitro compound - C-nitro compound - Carboxylic acid derivative - Allyl-type 1,3-dipolar organic compound - Organic oxoazanium - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Azacycle - Amidine - Organic nitrogen compound - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Organic zwitterion - Carbonyl group - Organic salt - Hydrocarbon derivative - Organic oxide - Organic oxygen 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