Compound Identification
SMILES
CCCC1CC2=C(CO1)SC1=NC(SCC3=C(Cl)C=CC=C3Cl)=NC(N)=C21
InChIKey
InChIKey=WFKNMPYLAFGKJA-UHFFFAOYSA-N
Formula
C19H19Cl2N3OS2
Mass
440.4
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
Thienopyrans Dichlorobenzenes Alkylarylthioethers Aminopyrimidines and derivatives Aryl chlorides Pyrans Imidolactams Primary aromatic amines Thiophenes Heteroaromatic compounds Sulfenyl compounds Dialkyl ethers Oxacyclic compounds Azacyclic compounds Hydrocarbon derivatives Organochlorides Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Thienopyran - Thienopyrimidine - Aryl thioether - 1,3-dichlorobenzene - Aminopyrimidine - Chlorobenzene - Halobenzene - Alkylarylthioether - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Primary aromatic amine - Pyran - Pyrimidine - Benzenoid - Imidolactam - Thiophene - Heteroaromatic compound - Dialkyl ether - Azacycle - Sulfenyl compound - Thioether - Oxacycle - Ether - Organic nitrogen compound - Organohalogen compound - Hydrocarbon derivative - Organochloride - Organopnictogen compound - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Primary amine - Amine - Organic oxygen 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