Compound Identification
SMILES
CCOC(=O)C1=C(C)N=C2N=CNN2[C@@H]1C1=CC=C(C=C1)C(O)=O
InChIKey
InChIKey=LWTZMBMIRIWHJU-CYBMUJFWSA-N
Formula
C16H16N4O4
Mass
328.328
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
Benzoic acids Benzoyl derivatives Hydropyrimidines Triazolines Enoate esters Amidrazones Propargyl-type 1,3-dipolar organic compounds Monocarboxylic acids and derivatives Formamidines Carboxylic acids Azacyclic compounds Organic oxides Imines Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzoic acid - Benzoic acid or derivatives - Triazolopyrimidine - Benzoyl - Hydropyrimidine - 1,6-dihydropyrimidine - Monocyclic benzene moiety - Benzenoid - Triazoline - Enoate ester - Alpha,beta-unsaturated carboxylic ester - Carboxylic acid ester - Carboxylic acid amidrazone - Carboxylic acid - Azacycle - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Formamidine - Amidine - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Organic nitrogen compound - Imine - Carbonyl group - Organonitrogen compound - Organooxygen compound - 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