Compound Identification
SMILES
CC1=C(C)C2=C(S1)N=C1SC(CNC3=CC=C(Cl)C=C3)=NN1C2=O
InChIKey
InChIKey=RFADIPMMZKMNDV-UHFFFAOYSA-N
Formula
C16H13ClN4OS2
Mass
376.88
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
Phenylalkylamines Aniline and substituted anilines Secondary alkylarylamines Pyrimidones Chlorobenzenes Aryl chlorides Thiophenes Thiadiazoles Heteroaromatic compounds Lactams Azacyclic compounds Organooxygen compounds Organochlorides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Thienopyrimidine - Aniline or substituted anilines - Phenylalkylamine - Chlorobenzene - Halobenzene - Pyrimidone - Secondary aliphatic/aromatic amine - Aralkylamine - Benzenoid - Monocyclic benzene moiety - Aryl halide - Aryl chloride - Pyrimidine - Azole - Thiophene - Heteroaromatic compound - Thiadiazole - Lactam - Azacycle - Secondary amine - Organohalogen compound - Organooxygen compound - Amine - Organic nitrogen compound - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organochloride - Organonitrogen 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