Compound Identification
SMILES
CCOC(=O)C1=C(C)C2=C(N)N=C(CSC3=NC(CC4=CC=CC=C4)=C(C)N3)N=C2S1
InChIKey
InChIKey=URBWNTNFCXKMOK-UHFFFAOYSA-N
Formula
C22H23N5O2S2
Mass
453.58
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
Thiophene carboxylic acids and derivatives 2,4,5-trisubstituted imidazoles Imidazolyl carboxylic acids and derivatives Alkylarylthioethers Aminopyrimidines and derivatives Imidolactams Benzene and substituted derivatives Heteroaromatic compounds Amino acids and derivatives Carboxylic acid esters Sulfenyl compounds Azacyclic compounds Hydrocarbon derivatives Organic oxides Organooxygen compounds Primary amines
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Thienopyrimidine - 2,4,5-trisubstituted-imidazole - Aryl thioether - Imidazolyl carboxylic acid derivative - Thiophene carboxylic acid or derivatives - Trisubstituted imidazole - Aminopyrimidine - Alkylarylthioether - Monocyclic benzene moiety - Pyrimidine - Benzenoid - Imidolactam - Thiophene - Heteroaromatic compound - Azole - Imidazole - Amino acid or derivatives - Carboxylic acid ester - Thioether - Sulfenyl compound - Azacycle - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Organosulfur compound - Primary amine - Amine - Hydrocarbon derivative - 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