Compound Identification
SMILES
CCOC1=NC2=C(C3=C(COC(C)(C)C3)S2)C2=NN=C(SCC=C(C)Cl)N12
InChIKey
InChIKey=ZTMLTVHKXKBIPW-UHFFFAOYSA-N
Formula
C18H21ClN4O2S2
Mass
424.96
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
Thienopyrimidines Thienopyrans Alkyl aryl ethers Alkylarylthioethers Pyrimidines and pyrimidine derivatives Pyrans Triazoles Thiophenes Heteroaromatic compounds Vinyl chlorides Sulfenyl compounds Azacyclic compounds Chloroalkenes Oxacyclic compounds Dialkyl ethers Hydrocarbon derivatives Organochlorides Organonitrogen compounds Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Thienopyran - Thienopyrimidine - Triazolopyrimidine - Aryl thioether - Alkyl aryl ether - Alkylarylthioether - Pyran - Pyrimidine - Azole - Heteroaromatic compound - Thiophene - Triazole - 1,2,4-triazole - Dialkyl ether - Ether - Oxacycle - Azacycle - Thioether - Chloroalkene - Haloalkene - Sulfenyl compound - Vinyl halide - Vinyl chloride - Organopnictogen compound - Hydrocarbon derivative - Organic oxygen compound - Organic nitrogen compound - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Organosulfur 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