Compound Identification
SMILES
CCC(SC1=NN2C(=N1)N=C(C)C(CC1=C(Cl)C=C(F)C=C1)=C2C)C(=O)NC1=CC=CC=C1OC
InChIKey
InChIKey=KLRBGZBRYLHIDS-UHFFFAOYSA-N
Formula
C25H25ClFN5O2S
Mass
514.02
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
Methoxyanilines Anilides Anisoles Methoxybenzenes N-arylamides Phenoxy compounds Chlorobenzenes Fluorobenzenes Alkyl aryl ethers Alkylarylthioethers Fatty amides Pyrimidines and pyrimidine derivatives Aryl chlorides Aryl fluorides Triazoles Heteroaromatic compounds Secondary carboxylic acid amides Sulfenyl compounds Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organochlorides Organofluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Triazolopyrimidine - Anilide - Methoxyaniline - Anisole - Phenoxy compound - Aryl thioether - Phenol ether - N-arylamide - Methoxybenzene - Alkyl aryl ether - Chlorobenzene - Fluorobenzene - Halobenzene - Alkylarylthioether - Fatty acyl - Aryl fluoride - Benzenoid - Aryl halide - Monocyclic benzene moiety - Fatty amide - Aryl chloride - Pyrimidine - 1,2,4-triazole - Triazole - Azole - Heteroaromatic compound - Secondary carboxylic acid amide - Carboxamide group - Sulfenyl compound - Thioether - Azacycle - Carboxylic acid derivative - Ether - Hydrocarbon derivative - Organic nitrogen compound - Organohalogen compound - Carbonyl group - Organochloride - Organofluoride - Organonitrogen compound - Organooxygen compound - Organosulfur compound - 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