Compound Identification
SMILES
CC(C)[C@H]1CC2=C(CO1)SC1=C2C(=O)N(C(S[C@H](C)C([O-])=O)=N1)C1=CC=CC=C1C
InChIKey
InChIKey=UECXPGDFTFJOFE-CZUORRHYSA-M
Formula
C22H23N2O4S2
Mass
443.56
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 Toluenes Alkylarylthioethers Pyrimidones Pyrans Thiophenes Heteroaromatic compounds Carboxylic acid salts Lactams Sulfenyl compounds Azacyclic compounds Oxacyclic compounds Carboxylic acids Dialkyl ethers Monocarboxylic acids and derivatives Organonitrogen compounds Hydrocarbon derivatives Organic oxides Carbonyl compounds Organic anions
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Thienopyran - Thienopyrimidine - Aryl thioether - Pyrimidone - Toluene - Alkylarylthioether - Pyran - Pyrimidine - Monocyclic benzene moiety - Benzenoid - Heteroaromatic compound - Thiophene - Carboxylic acid salt - Lactam - Sulfenyl compound - Carboxylic acid derivative - Thioether - Carboxylic acid - Dialkyl ether - Azacycle - Oxacycle - Ether - Monocarboxylic acid or derivatives - Carbonyl group - Organic oxide - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic nitrogen compound - Organic oxygen compound - Hydrocarbon derivative - Organic anion - 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