Compound Identification
SMILES
CCOC(=O)C1=C(C)C2=C(N=C(CSC3=CC=CC=C3)N=C2S1)N(C)CCO
InChIKey
InChIKey=NZIGJGYXRNRKFH-UHFFFAOYSA-N
Formula
C20H23N3O3S2
Mass
417.54
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
Thiophenol ethers Thiophene carboxylic acids and derivatives Dialkylarylamines Aminopyrimidines and derivatives Alkylarylthioethers Imidolactams Benzene and substituted derivatives Heteroaromatic compounds Carboxylic acid esters Sulfenyl compounds Azacyclic compounds Alkanolamines Primary alcohols Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Thienopyrimidine - Thiophene carboxylic acid or derivatives - Thiophenol ether - Dialkylarylamine - Aryl thioether - Aminopyrimidine - Alkylarylthioether - Monocyclic benzene moiety - Imidolactam - Benzenoid - Pyrimidine - Heteroaromatic compound - Thiophene - Carboxylic acid ester - Azacycle - Carboxylic acid derivative - Sulfenyl compound - Alkanolamine - Thioether - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic oxide - Organic oxygen compound - Amine - Primary alcohol - Hydrocarbon derivative - Organic nitrogen compound - Alcohol - 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