Compound Identification
SMILES
COC1=CC=C(NC2=NN=C(SCC3=NC4=C(C5=C(CCC5)S4)C(=O)N3)S2)C=C1
InChIKey
InChIKey=UHMWDJIAHPTNGC-UHFFFAOYSA-N
Formula
C19H17N5O2S3
Mass
443.56
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
Methoxyanilines Anisoles Methoxybenzenes Phenoxy compounds 2-amino-5-substituted-1,3,4-thiadiazoles Alkyl aryl ethers Alkylarylthioethers Pyrimidones Heteroaromatic compounds Thiophenes Lactams Azacyclic compounds Sulfenyl compounds Secondary amines Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Thienopyrimidine - Methoxyaniline - Anisole - Phenoxy compound - Aryl thioether - Phenol ether - Aniline or substituted anilines - Methoxybenzene - Alkyl aryl ether - Pyrimidone - Alkylarylthioether - 2-amino-5-substituted-1,3,4-thiadiazole - 2-amino-1,3,4-thiadiazole - Benzenoid - Monocyclic benzene moiety - Pyrimidine - Heteroaromatic compound - Azole - Thiophene - Thiadiazole - Lactam - Azacycle - Ether - Sulfenyl compound - Secondary amine - Thioether - Amine - Organic oxygen compound - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Hydrocarbon derivative - 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