Compound Identification
SMILES
C[C@H](SC1=NC=NC2=C1SC1=NC(N3CCOCC3)=C3CCCCC3=C21)C(O)=O
InChIKey
InChIKey=QFIBGTBUTSLTIB-NSHDSACASA-N
Formula
C20H22N4O3S2
Mass
430.54
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
Thienopyridines Dialkylarylamines Alkylarylthioethers Aminopyridines and derivatives Pyrimidines and pyrimidine derivatives Morpholines Imidolactams Thiophenes Heteroaromatic compounds Sulfenyl compounds Oxacyclic compounds Azacyclic compounds Monocarboxylic acids and derivatives Dialkyl ethers Carboxylic acids Organic oxides Carbonyl compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Thienopyridine - Thienopyrimidine - Aryl thioether - Dialkylarylamine - Aminopyridine - Alkylarylthioether - Morpholine - Oxazinane - Pyridine - Pyrimidine - Imidolactam - Heteroaromatic compound - Thiophene - Carboxylic acid derivative - Carboxylic acid - Dialkyl ether - Ether - Monocarboxylic acid or derivatives - Oxacycle - Azacycle - Sulfenyl compound - Thioether - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic oxide - Hydrocarbon derivative - Organic nitrogen compound - Carbonyl group - Amine - 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