Compound Identification
SMILES
CC1CCC2=C(C1)SC1=NC=NC(OCC(=O)N(C)CCC#N)=C21
InChIKey
InChIKey=XJUJDZZSHQKNGY-UHFFFAOYSA-N
Formula
C17H20N4O2S
Mass
344.43
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
Alkyl aryl ethers Pyrimidines and pyrimidine derivatives Thiophenes Tertiary carboxylic acid amides Heteroaromatic compounds Nitriles Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Thienopyrimidine - Alkyl aryl ether - Pyrimidine - Tertiary carboxylic acid amide - Thiophene - Heteroaromatic compound - Carboxamide group - Azacycle - Nitrile - Carbonitrile - Ether - Carboxylic acid derivative - Cyanide - Organic nitrogen compound - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Carbonyl group - Hydrocarbon derivative - 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