Compound Identification
SMILES
CC(C)CN1C2=C(C(SC(C)C)=C(CN3C(=O)C4=CC=CC=C4S3(=O)=O)S2)C(=O)N(C)C1=O
InChIKey
InChIKey=HFOJUXQKGRRLJK-UHFFFAOYSA-N
Formula
C22H25N3O5S3
Mass
507.64
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Thienopyrimidines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Thienopyrimidines
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Thienopyrimidines
Alternative Parents
Benzothiazoles Alkylarylthioethers Pyrimidones Vinylogous thioesters Benzenoids Vinylogous amides Thiophenes Organosulfonic acids and derivatives Heteroaromatic compounds Ureas Lactams Sulfenyl compounds Azacyclic compounds Carboxylic acids and derivatives Organonitrogen compounds Organooxygen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1,2-benzothiazole - Thienopyrimidine - Aryl thioether - Pyrimidone - Alkylarylthioether - Pyrimidine - Benzenoid - Vinylogous thioester - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Thiophene - Heteroaromatic compound - Vinylogous amide - Urea - Lactam - Carboxylic acid derivative - Thioether - Sulfenyl compound - Azacycle - Hydrocarbon derivative - Organic nitrogen compound - Organic oxide - Organic oxygen compound - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as thienopyrimidines. These are heterocyclic compounds containing a thiophene ring fused to a pyrimidine ring. Thiophene is 5-membered ring consisting of four carbon atoms and one sulfur atom. 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