Compound Identification
SMILES
COC1=CC=CC=C1[C@@H](NC(=O)CSCC1=NC2=C(C3=C(CCC3)S2)C(=O)N1)C1=NC=CN1C
InChIKey
InChIKey=PUNZNXLLMCXYSU-OAQYLSRUSA-N
Formula
C24H25N5O3S2
Mass
495.62
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
Anisoles Methoxybenzenes Phenoxy compounds Pyrimidones Alkyl aryl ethers N-substituted imidazoles Heteroaromatic compounds Thiophenes Lactams Secondary carboxylic acid amides Azacyclic compounds Dialkylthioethers Sulfenyl compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Thienopyrimidine - Phenoxy compound - Anisole - Phenol ether - Methoxybenzene - Alkyl aryl ether - Pyrimidone - Pyrimidine - Monocyclic benzene moiety - N-substituted imidazole - Benzenoid - Thiophene - Azole - Heteroaromatic compound - Imidazole - Lactam - Secondary carboxylic acid amide - Carboxamide group - Azacycle - Carboxylic acid derivative - Ether - Dialkylthioether - Sulfenyl compound - Thioether - Organic oxygen compound - Organic nitrogen compound - Organic oxide - Hydrocarbon derivative - Carbonyl group - Organonitrogen compound - Organooxygen compound - Organosulfur 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