Compound Identification
SMILES
COC1=CC=CC=C1NC(=O)C1=C(C)N=C2N=C(NN2[C@H]1C1=CC=CC=N1)SCC1=CC=CC=C1F
InChIKey
InChIKey=XRXFWNJXVVNSNO-QHCPKHFHSA-N
Formula
C26H23FN6O2S
Mass
502.57
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 Methoxyanilines Pyrimidinecarboxamides Anisoles Methoxybenzenes N-arylamides Phenoxy compounds Alkyl aryl ethers Fluorobenzenes Hydropyrimidines Aryl fluorides Pyridines and derivatives Triazolines Heteroaromatic compounds Secondary carboxylic acid amides Sulfenyl compounds Azacyclic compounds Propargyl-type 1,3-dipolar organic compounds Organofluorides Organic oxides Imines Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Pyrimidinecarboxamide - Triazolopyrimidine - Anilide - Methoxyaniline - Anisole - Phenol ether - Phenoxy compound - N-arylamide - Methoxybenzene - Halobenzene - Fluorobenzene - Alkyl aryl ether - Hydropyrimidine - 1,6-dihydropyrimidine - Monocyclic benzene moiety - Pyridine - Aryl halide - Aryl fluoride - Benzenoid - Heteroaromatic compound - Triazoline - Secondary carboxylic acid amide - Carboxamide group - Organic 1,3-dipolar compound - Ether - Azacycle - Sulfenyl compound - Carboxylic acid derivative - Propargyl-type 1,3-dipolar organic compound - Organic oxide - Imine - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Carbonyl group - Organosulfur compound - Organic nitrogen compound - Organic oxygen compound - Hydrocarbon derivative - 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