Compound Identification
SMILES
NC(=S)CC1=NC(=CS1)C1=CC2=CC=CC=C2OC1=O
InChIKey
InChIKey=HOBNPMTXALDUAV-UHFFFAOYSA-N
Formula
C14H10N2O2S2
Mass
302.37
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Coumarins and derivatives
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Coumarins and derivatives
Alternative Parents
1-benzopyrans 2,4-disubstituted thiazoles Pyranones and derivatives Benzenoids Thioamides Heteroaromatic compounds Lactones Thiocarboxylic acid amides Azacyclic compounds Oxacyclic compounds Organooxygen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Thiocarbonyl compounds Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Coumarin - Benzopyran - 1-benzopyran - 2,4-disubstituted 1,3-thiazole - Pyranone - Benzenoid - Pyran - Azole - Heteroaromatic compound - Thioamide - Thiazole - Lactone - Oxacycle - Azacycle - Organoheterocyclic compound - Thiocarboxylic acid amide - Organic nitrogen compound - Thiocarbonyl group - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as coumarins and derivatives. These are polycyclic aromatic compounds containing a 1-benzopyran moiety with a ketone group at the C2 carbon atom (1-benzopyran-2-one).
External Descriptors
Not available