Compound Identification
SMILES
CC(C)(CO)NC1CCC2=C(C1)SC1=C2C(=O)N(CCC2=CC=C(F)C=C2)C=N1
InChIKey
InChIKey=QLDIFFJOVFEFCI-UHFFFAOYSA-N
Formula
C22H26FN3O2S
Mass
415.53
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
Pyrimidones Fluorobenzenes Aralkylamines Aryl fluorides Thiophenes Heteroaromatic compounds Lactams 1,2-aminoalcohols Dialkylamines Azacyclic compounds Primary alcohols Organofluorides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Thienopyrimidine - Fluorobenzene - Aralkylamine - Halobenzene - Pyrimidone - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Pyrimidine - Heteroaromatic compound - Thiophene - 1,2-aminoalcohol - Lactam - Secondary aliphatic amine - Azacycle - Secondary amine - Organohalogen compound - Primary alcohol - Amine - Alcohol - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organofluoride - Organonitrogen compound - Organooxygen 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