Compound Identification
SMILES
NC1=C(C#N)C(C2=C(O1)C1=C(SC2)C=CC(Cl)=C1)C1=CC2=C(OCO2)C=C1
InChIKey
InChIKey=PFOYZSSVEDRDSJ-UHFFFAOYSA-N
Formula
C20H13ClN2O3S
Mass
396.85
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Thiochromenes
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Thiochromenes
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Thiochromenes
Alternative Parents
Benzodioxoles 1-benzothiopyrans Alkylarylthioethers Thiopyrans Pyrans Benzenoids Aryl chlorides Ketene acetals Oxacyclic compounds Nitriles Acetals Organopnictogen compounds Organochlorides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2h-thiochromene - Benzodioxole - 1-benzothiopyran - Benzothiopyran - Aryl thioether - Alkylarylthioether - Aryl chloride - Aryl halide - Pyran - Benzenoid - Thiopyran - Ketene acetal or derivatives - Acetal - Carbonitrile - Nitrile - Oxacycle - Thioether - Organochloride - Organohalogen compound - Organic nitrogen compound - Cyanide - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxygen compound - Organopnictogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as thiochromenes. These are organosulfur compounds that are analogues to chromene, with the difference that a sulfur atom replaces the oxygen atom.
External Descriptors
Not available