Compound Identification
SMILES
CC(=O)N1CCC2=C(C1)SC1=C2C(=O)N(C(=O)N1CC1=CC=C(C=C)C=C1)C1=CC=CC=C1Cl
InChIKey
InChIKey=PJDJLISLUKIOCI-UHFFFAOYSA-N
Formula
C26H22ClN3O3S
Mass
491.99
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
Styrenes Chlorobenzenes Pyrimidones Aryl chlorides Tertiary carboxylic acid amides Vinylogous amides Heteroaromatic compounds Acetamides Thiophenes Lactams Ureas Azacyclic compounds Organonitrogen compounds Organochlorides Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Thienopyrimidine - Styrene - Chlorobenzene - Halobenzene - Pyrimidone - Benzenoid - Monocyclic benzene moiety - Aryl halide - Pyrimidine - Aryl chloride - Acetamide - Vinylogous amide - Thiophene - Heteroaromatic compound - Tertiary carboxylic acid amide - Urea - Carboxamide group - Lactam - Azacycle - Carboxylic acid derivative - Organic oxide - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Carbonyl group - Organic nitrogen compound - Organic oxygen compound - Hydrocarbon derivative - 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