Compound Identification
SMILES
COC1=CC=CC(=C1)[C@@H]1C[C@@H](N2NC=C(C(=O)NC3=CC=CC(=C3)[C@@H](C)O)C2=N1)C(F)(F)F
InChIKey
InChIKey=GFNNWRHAFQZHNO-CAYVGHNUSA-N
Formula
C23H23F3N4O3
Mass
460.457
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
Anilides Pyrimidinecarboxamides Anisoles Methoxybenzenes Phenoxy compounds N-arylamides Alkyl aryl ethers Hydropyrimidines Imidolactams Vinylogous amides Pyrazolines Pyrazoles Secondary alcohols Secondary carboxylic acid amides Amidrazones Amidines Azacyclic compounds Propargyl-type 1,3-dipolar organic compounds Alkyl fluorides Hydrocarbon derivatives Carbonyl compounds Aromatic alcohols Organofluorides Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Pyrimidinecarboxamide - Pyrazolopyrimidine - Anilide - Phenoxy compound - Anisole - N-arylamide - Methoxybenzene - Phenol ether - Alkyl aryl ether - Pyrimidine - Monocyclic benzene moiety - Hydropyrimidine - Imidolactam - Benzenoid - 1,4,5,6-tetrahydropyrimidine - Pyrazole - Vinylogous amide - Pyrazoline - Carboxylic acid amidrazone - Carboxamide group - Secondary carboxylic acid amide - Secondary alcohol - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Amidine - Carboxylic acid derivative - Ether - Azacycle - Alkyl halide - Hydrocarbon derivative - Organohalogen compound - Organofluoride - Organic nitrogen compound - Carbonyl group - Organic oxide - Organic oxygen compound - Alcohol - Organonitrogen compound - Organooxygen compound - Aromatic alcohol - Alkyl fluoride - 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