Compound Identification
SMILES
CC1=CC(C(=O)COC(=O)CCC2=NC3=C(C4=C(CCCC4)S3)C(=O)N2)=C(C)N1CC1CCCO1
InChIKey
InChIKey=PGDYJVYSSDDFKM-UHFFFAOYSA-N
Formula
C26H31N3O5S
Mass
497.61
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
Aryl alkyl ketones Pyrimidones Alpha-acyloxy ketones Fatty acid esters Substituted pyrroles Vinylogous amides Thiophenes Oxolanes Heteroaromatic compounds Carboxylic acid esters Lactams Oxacyclic compounds Azacyclic compounds Dialkyl ethers Monocarboxylic acids and derivatives Organonitrogen compounds Organopnictogen compounds Organic oxides Aldehydes Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Thienopyrimidine - Aryl ketone - Aryl alkyl ketone - Fatty acid ester - Pyrimidone - Alpha-acyloxy ketone - Pyrimidine - Substituted pyrrole - Fatty acyl - Oxolane - Pyrrole - Thiophene - Heteroaromatic compound - Vinylogous amide - Carboxylic acid ester - Ketone - Lactam - Azacycle - Oxacycle - Carboxylic acid derivative - Dialkyl ether - Ether - Monocarboxylic acid or derivatives - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Aldehyde - Organic oxygen compound - Carbonyl group - 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