Compound Identification
SMILES
CN1CCC2=C(C1)SC1=C2C(=O)N(C2=NN=C(SCC(=O)N3CCCC3)N12)C1=CC=C(Cl)C=C1
InChIKey
InChIKey=ZOPKOFLTVVNABI-UHFFFAOYSA-N
Formula
C23H23ClN6O2S2
Mass
515.05
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 N-acylpyrrolidines Alkylarylthioethers Aralkylamines Chlorobenzenes Pyrimidones Aryl chlorides Vinylogous amides Triazoles Thiophenes Heteroaromatic compounds Tertiary carboxylic acid amides Trialkylamines Amino acids and derivatives Lactams Azacyclic compounds Sulfenyl compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides Organochlorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Triazolopyrimidine - Thienopyrimidine - Aryl thioether - N-acylpyrrolidine - Chlorobenzene - Halobenzene - Aralkylamine - Alkylarylthioether - Pyrimidone - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Pyrimidine - Benzenoid - Azole - Heteroaromatic compound - Vinylogous amide - Pyrrolidine - Tertiary carboxylic acid amide - 1,2,4-triazole - Thiophene - Triazole - Tertiary aliphatic amine - Tertiary amine - Carboxamide group - Amino acid or derivatives - Lactam - Sulfenyl compound - Thioether - Carboxylic acid derivative - Azacycle - Carbonyl group - Organohalogen compound - Hydrocarbon derivative - Organochloride - Organonitrogen compound - Organic nitrogen compound - Organooxygen compound - Organic oxygen compound - Amine - Organosulfur compound - Organic oxide - 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