Compound Identification
SMILES
CCOC(=O)C1=C(F)C=C(C=C1)C#CC1=CC2=C(SC(C)(C)C=C2C2=CC=C(C)C=C2)C=C1
InChIKey
InChIKey=PXOBDPMGHPFAIO-UHFFFAOYSA-N
Formula
C29H25FO2S
Mass
456.58
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
Benzoic acid esters 2-halobenzoic acids and derivatives 1-benzothiopyrans Benzoyl derivatives Toluenes Fluorobenzenes Alkylarylthioethers Thiopyrans Aryl fluorides Vinylogous halides Carboxylic acid esters Organooxygen compounds Organofluorides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzoate ester - 2h-thiochromene - 2-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Benzoic acid or derivatives - 1-benzothiopyran - Benzothiopyran - Aryl thioether - Benzoyl - Fluorobenzene - Halobenzene - Toluene - Alkylarylthioether - Aryl fluoride - Thiopyran - Aryl halide - Monocyclic benzene moiety - Benzenoid - Vinylogous halide - Carboxylic acid ester - Thioether - Carboxylic acid derivative - Organooxygen compound - Organofluoride - Organohalogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen 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