Compound Identification
SMILES
ClC1=CC=CC(\C=C2/COCC3=C2NC(=S)NC3C2=CC(Cl)=CC=C2)=C1
InChIKey
InChIKey=MQCWZMBQLKKRLW-VGOFMYFVSA-N
Formula
C20H16Cl2N2OS
Mass
403.32
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Pyranopyrimidines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyranopyrimidines
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Pyranopyrimidines
Alternative Parents
Pyranopyridines Pyrimidinethiones 2-Thiopyrimidines Chlorobenzenes Pyridines and derivatives Pyrans Aryl chlorides Hydropyrimidines Thioureas Oxacyclic compounds Azacyclic compounds Dialkyl ethers Organonitrogen compounds Organopnictogen compounds Hydrocarbon derivatives Organochlorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Pyranopyridine - Pyranopyrimidine - Chlorobenzene - Halobenzene - 2-thiopyrimidine - Pyrimidinethione - Thiopyrimidine - Aryl chloride - Benzenoid - Monocyclic benzene moiety - Pyrimidine - Pyridine - Pyran - Aryl halide - Hydropyrimidine - 1,2,3,4-tetrahydropyrimidine - Thiourea - Oxacycle - Dialkyl ether - Ether - Azacycle - Organosulfur compound - Organic nitrogen compound - Hydrocarbon derivative - Organopnictogen compound - Organic oxygen compound - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as pyranopyrimidines. These are polycyclic aromatic compounds containing a pyran ring fused to a pyrimidine ring.
External Descriptors
Not available