Compound Identification
SMILES
CC1CCC2=C(C1)SC1=C2C(=O)NC(CSC2=NC3=C(S2)C=CC(Cl)=C3)=N1
InChIKey
InChIKey=QUAPSTXNRDYREA-UHFFFAOYSA-N
Formula
C19H16ClN3OS3
Mass
433.99
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 Aryl chlorides Benzenoids Heteroaromatic compounds Thiophenes Thiazoles Lactams Azacyclic compounds Sulfenyl compounds Organooxygen compounds Organonitrogen compounds Organochlorides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1,3-benzothiazole - Thienopyrimidine - Aryl thioether - Pyrimidone - Alkylarylthioether - Aryl chloride - Aryl halide - Pyrimidine - Benzenoid - Azole - Heteroaromatic compound - Thiazole - Thiophene - Lactam - Azacycle - Thioether - Sulfenyl compound - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Organic oxide - 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