Compound Identification
SMILES
COC(=O)C1=C(CSC2=NC3=C(C(=CS3)C3=CC=CC=C3)C(=O)N2N)OC=C1
InChIKey
InChIKey=JDRUBEVRAQQVGE-UHFFFAOYSA-N
Formula
C19H15N3O4S2
Mass
413.47
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
Furoic acid esters Furan-3-carboxylic acid esters Alkylarylthioethers Pyrimidones Benzene and substituted derivatives Thiophenes Heteroaromatic compounds Methyl esters Lactams Azacyclic compounds Oxacyclic compounds Sulfenyl compounds Hydrocarbon derivatives Organooxygen compounds Organic oxides Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Furoic acid ester - Thienopyrimidine - Furoic acid or derivatives - Furan-3-carboxylic acid ester - Furan-3-carboxylic acid or derivatives - Aryl thioether - Pyrimidone - Alkylarylthioether - Monocyclic benzene moiety - Pyrimidine - Benzenoid - Furan - Thiophene - Methyl ester - Heteroaromatic compound - Carboxylic acid ester - Lactam - Sulfenyl compound - Carboxylic acid derivative - Thioether - Oxacycle - Azacycle - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Organosulfur compound - Hydrocarbon derivative - Organic oxide - Organic oxygen 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