Compound Identification
SMILES
COC1=CC2=C(SCC3=C2OC(N)=C(C#N)C3C2=CC3=C(OCO3)C=C2)C=C1
InChIKey
InChIKey=AUJWQHGICXDOHP-UHFFFAOYSA-N
Formula
C21H16N2O4S
Mass
392.43
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 Anisoles Alkylarylthioethers Alkyl aryl ethers Thiopyrans Pyrans Ketene acetals Oxacyclic compounds Nitriles Acetals Organopnictogen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2h-thiochromene - Benzodioxole - 1-benzothiopyran - Benzothiopyran - Aryl thioether - Anisole - Alkyl aryl ether - Alkylarylthioether - Pyran - Thiopyran - Benzenoid - Ketene acetal or derivatives - Thioether - Nitrile - Carbonitrile - Acetal - Ether - Oxacycle - Hydrocarbon derivative - Cyanide - Organooxygen compound - Organonitrogen compound - Organopnictogen compound - Organic oxygen compound - Organic nitrogen 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