Compound Identification
SMILES
CSC1=NN2C(=N1)N=C(C)C(CC(=O)N(C)C1=NC3=CC=CC=C3S1)=C2C
InChIKey
InChIKey=IWWLBTRQCVQEGK-UHFFFAOYSA-N
Formula
C18H18N6OS2
Mass
398.5
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
Benzothiazoles Alkylarylthioethers Pyrimidines and pyrimidine derivatives Benzenoids Triazoles Thiazoles Tertiary carboxylic acid amides Heteroaromatic compounds Tertiary amines Amino acids and derivatives Sulfenyl compounds Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1,3-benzothiazole - Triazolopyrimidine - Aryl thioether - Alkylarylthioether - Pyrimidine - Benzenoid - Azole - Tertiary carboxylic acid amide - Thiazole - Triazole - 1,2,4-triazole - Heteroaromatic compound - Amino acid or derivatives - Tertiary amine - Carboxamide group - Azacycle - Thioether - Sulfenyl compound - Carboxylic acid derivative - Amine - Organooxygen compound - Organonitrogen compound - Organosulfur compound - Organic oxygen compound - Organic nitrogen compound - Organic oxide - Hydrocarbon derivative - Carbonyl group - 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