Compound Identification
SMILES
ClCCC(=O)NCCNC1=NC2=C(SC=C2)C(=N1)C(=O)C1=CC=CS1
InChIKey
InChIKey=JUXISJCXDPTPRG-UHFFFAOYSA-N
Formula
C16H15ClN4O2S2
Mass
394.89
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
Pyrimidinecarboxylic acids and derivatives Thiophene carboxylic acids and derivatives Aryl ketones Aminopyrimidines and derivatives Heteroaromatic compounds Secondary carboxylic acid amides Azacyclic compounds Organochlorides Organic oxides Hydrocarbon derivatives Amines Alkyl chlorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Pyrimidine-6-carboxylic acid or derivatives - Thienopyrimidine - Thiophene carboxylic acid or derivatives - Aryl ketone - Aminopyrimidine - Pyrimidine - Heteroaromatic compound - Thiophene - Carboxamide group - Secondary carboxylic acid amide - Ketone - Azacycle - Carboxylic acid derivative - Organic oxide - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Organic nitrogen compound - Organic oxygen compound - Alkyl chloride - Carbonyl group - Alkyl halide - Amine - 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