Compound Identification
SMILES
CCOC(=O)C(C(C)=O)C1=C2C(CSC2=NC(=N1)C1=CC=CC=C1)C1=CC=CC=C1
InChIKey
InChIKey=BMQVFHCIVWSKGN-UHFFFAOYSA-N
Formula
C24H22N2O3S
Mass
418.51
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
Fatty acid esters Beta-keto acids and derivatives Alkylarylthioethers Pyrimidines and pyrimidine derivatives Benzene and substituted derivatives 1,3-dicarbonyl compounds Heteroaromatic compounds Ketones Carboxylic acid esters Monocarboxylic acids and derivatives Azacyclic compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Thienopyrimidine - Aryl thioether - Beta-keto acid - Fatty acid ester - Alkylarylthioether - Monocyclic benzene moiety - Fatty acyl - Keto acid - Benzenoid - 1,3-dicarbonyl compound - Pyrimidine - Heteroaromatic compound - Carboxylic acid ester - Ketone - Monocarboxylic acid or derivatives - Azacycle - Carboxylic acid derivative - Thioether - Organooxygen compound - Organonitrogen compound - Organic oxide - Organic oxygen compound - Carbonyl group - Hydrocarbon derivative - Organic nitrogen 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