Compound Identification
SMILES
CCOC1=CC=C(C=C1)C1=CSC(=N1)C(=CC1=CC2=C(OCO2)C=C1)C#N
InChIKey
InChIKey=DVKXJACNGFVZAX-UHFFFAOYSA-N
Formula
C21H16N2O3S
Mass
376.43
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Benzodioxoles
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzodioxoles
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Benzodioxoles
Alternative Parents
Phenoxy compounds Phenol ethers Alkyl aryl ethers 2,4-disubstituted thiazoles Heteroaromatic compounds Oxacyclic compounds Nitriles Azacyclic compounds Acetals Organopnictogen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzodioxole - Phenol ether - Phenoxy compound - Alkyl aryl ether - 2,4-disubstituted 1,3-thiazole - Monocyclic benzene moiety - Benzenoid - Azole - Heteroaromatic compound - Thiazole - Acetal - Ether - Carbonitrile - Nitrile - Oxacycle - Azacycle - Organic oxygen compound - Organic nitrogen compound - Organopnictogen compound - Organonitrogen compound - Organooxygen compound - Cyanide - Hydrocarbon derivative - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as benzodioxoles. These are organic compounds containing a benzene ring fused to either isomers of dioxole. Dioxole is a five-membered unsaturated ring of two oxygen atoms and three carbon atoms.
External Descriptors
Not available