Compound Identification
SMILES
CC(C)C1CC2=C(CO1)SC1=C2C(=O)N(C2=NN=C(SCC(N)=O)N12)C1=CC=C(C)C=C1
InChIKey
InChIKey=PCWUTKKSSHWMCW-UHFFFAOYSA-N
Formula
C22H23N5O3S2
Mass
469.58
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 Toluenes Alkylarylthioethers Pyrimidones Pyrans Vinylogous amides Triazoles Thiophenes Heteroaromatic compounds Primary carboxylic acid amides Lactams Sulfenyl compounds Azacyclic compounds Dialkyl ethers Oxacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organopnictogen compounds Organic oxides Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Thienopyrimidine - Thienopyran - Triazolopyrimidine - Aryl thioether - Toluene - Pyrimidone - Alkylarylthioether - Monocyclic benzene moiety - Pyran - Pyrimidine - Benzenoid - Azole - Thiophene - Triazole - Vinylogous amide - Heteroaromatic compound - 1,2,4-triazole - Primary carboxylic acid amide - Carboxamide group - Lactam - Carboxylic acid derivative - Dialkyl ether - Ether - Oxacycle - Azacycle - Sulfenyl compound - Thioether - Organonitrogen compound - Organic oxide - Organic oxygen compound - Organooxygen compound - Organosulfur compound - Hydrocarbon derivative - Carbonyl group - Organopnictogen compound - Organic nitrogen 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