Compound Identification
SMILES
FC1=CC=C(COC2=C(Cl)C=C(NC3=C4C5=C(CC(CC(=O)N6CCCC6)CC5)SC4=NC=N3)C=C2)C=C1
InChIKey
InChIKey=UGHLRNAYTMRGSK-UHFFFAOYSA-N
Formula
C29H28ClFN4O2S
Mass
551.08
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
Phenoxy compounds Phenol ethers Aniline and substituted anilines N-acylpyrrolidines Alkyl aryl ethers Aminopyrimidines and derivatives Chlorobenzenes Fluorobenzenes Aryl chlorides Aryl fluorides Imidolactams Thiophenes Tertiary carboxylic acid amides Heteroaromatic compounds Azacyclic compounds Organic oxides Organochlorides Organofluorides Carbonyl compounds Hydrocarbon derivatives Amines
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Thienopyrimidine - Phenoxy compound - Phenol ether - N-acylpyrrolidine - Aniline or substituted anilines - Alkyl aryl ether - Aminopyrimidine - Chlorobenzene - Fluorobenzene - Halobenzene - Benzenoid - Imidolactam - Aryl halide - Aryl fluoride - Pyrimidine - Aryl chloride - Monocyclic benzene moiety - Pyrrolidine - Tertiary carboxylic acid amide - Thiophene - Heteroaromatic compound - Carboxamide group - Ether - Carboxylic acid derivative - Azacycle - Organochloride - Organofluoride - Organonitrogen compound - Organic nitrogen compound - Carbonyl group - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Amine - Organohalogen 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