Compound Identification
SMILES
CC(C)OC(=O)C1=C(COCCN)N=C2N(NC=C2C#N)C1C1=C(F)C(F)=CC=C1
InChIKey
InChIKey=MAXZLHWGLDVFNV-UHFFFAOYSA-N
Formula
C20H21F2N5O3
Mass
417.417
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Pyrazolopyrimidines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyrazolopyrimidines
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Pyrazolopyrimidines
Alternative Parents
Fluorobenzenes Imidolactams Hydropyrimidines Aryl fluorides Pyrazolines Pyrazoles Enoate esters Amidrazones Amino acids and derivatives Propargyl-type 1,3-dipolar organic compounds Amidines Nitriles Monocarboxylic acids and derivatives Dialkyl ethers Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Monoalkylamines Organic oxides Organofluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Pyrazolopyrimidine - Fluorobenzene - Halobenzene - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Hydropyrimidine - Imidolactam - 1,6-dihydropyrimidine - Benzenoid - Pyrimidine - Pyrazole - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Pyrazoline - Carboxylic acid amidrazone - Amino acid or derivatives - Carboxylic acid ester - Propargyl-type 1,3-dipolar organic compound - Amidine - Carboxylic acid derivative - Dialkyl ether - Ether - Azacycle - Organic 1,3-dipolar compound - Monocarboxylic acid or derivatives - Carbonitrile - Nitrile - Organic oxide - Primary amine - Amine - Hydrocarbon derivative - Organic nitrogen compound - Organic oxygen compound - Primary aliphatic amine - Cyanide - Carbonyl group - Organooxygen compound - Organohalogen compound - Organofluoride - Organonitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as pyrazolopyrimidines. These are compounds containing a pyrazolopyrimidine skeleton, which consists of a pyrazole fused to a pyrimidine. Pyrazole is 5-membered ring consisting of three carbon atoms and two adjacent nitrogen centers. Pyrimidine is 6-membered ring consisting of four carbon atoms and two adjacent nitrogen atoms at the 1- and 3- ring position.
External Descriptors
Not available