Compound Identification
SMILES
COC1=CC=CC(CNC2=NC3=C(SC(=C3)C3=CC(=CC=C3)C(=O)NCCO)C(=O)N2C)=C1
InChIKey
InChIKey=YHNSFOZPQAPASL-UHFFFAOYSA-N
Formula
C24H24N4O4S
Mass
464.54
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
Benzamides 2,3,5-trisubstituted thiophenes Phenoxy compounds N-acylethanolamines Methoxybenzenes Benzylamines Benzoyl derivatives Anisoles Secondary alkylarylamines Pyrimidones Alkyl aryl ethers Aminopyrimidines and derivatives Heteroaromatic compounds Secondary carboxylic acid amides Lactams Amino acids and derivatives Azacyclic compounds Hydrocarbon derivatives Organic oxides Primary alcohols
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Thienopyrimidine - Benzoic acid or derivatives - Benzamide - Phenol ether - N-acylethanolamine - Benzylamine - Benzoyl - 2,3,5-trisubstituted thiophene - Methoxybenzene - Phenoxy compound - Anisole - Pyrimidone - Alkyl aryl ether - Aminopyrimidine - Secondary aliphatic/aromatic amine - Pyrimidine - Benzenoid - Monocyclic benzene moiety - Heteroaromatic compound - Thiophene - Amino acid or derivatives - Secondary carboxylic acid amide - Carboxamide group - Lactam - Carboxylic acid derivative - Alkanolamine - Azacycle - Ether - Secondary amine - Organic nitrogen compound - Organooxygen compound - Alcohol - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Primary alcohol - Amine - Organonitrogen 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