Compound Identification
SMILES
COC1=CC=C(C=C1)C1=NN=C(O1)SCC1=NC2=C(C3=C(CCCC3)S2)C(=O)N1
InChIKey
InChIKey=MBDLOIUPLOWNKL-UHFFFAOYSA-N
Formula
C20H18N4O3S2
Mass
426.51
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
Phenoxy compounds Anisoles Methoxybenzenes Pyrimidones Alkyl aryl ethers Alkylarylthioethers Thiophenes 1,3,4-oxadiazoles Heteroaromatic compounds Lactams Sulfenyl compounds Oxacyclic compounds Azacyclic compounds Organonitrogen compounds Organopnictogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Thienopyrimidine - Phenol ether - Methoxybenzene - Anisole - Aryl thioether - Phenoxy compound - Alkylarylthioether - Alkyl aryl ether - Pyrimidone - Monocyclic benzene moiety - Benzenoid - Pyrimidine - Heteroaromatic compound - Oxadiazole - 1,3,4-oxadiazole - Azole - Thiophene - Lactam - Ether - Oxacycle - Azacycle - Sulfenyl compound - Thioether - Organonitrogen compound - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organooxygen compound - Organosulfur compound - Organopnictogen compound - Organic oxide - 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