Compound Identification
SMILES
CCN(CC1=CC2=C(OCO2)C=C1)C(=O)CSC1=NC=C(C#N)C(N)=N1
InChIKey
InChIKey=MVJWRRWNCOOVMB-UHFFFAOYSA-N
Formula
C17H17N5O3S
Mass
371.42
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
Alkylarylthioethers Aminopyrimidines and derivatives Primary aromatic amines Imidolactams Benzenoids Tertiary carboxylic acid amides Heteroaromatic compounds Amino acids and derivatives Sulfenyl compounds Oxacyclic compounds Acetals Nitriles Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzodioxole - Aryl thioether - Aminopyrimidine - Alkylarylthioether - Primary aromatic amine - Pyrimidine - Benzenoid - Imidolactam - Heteroaromatic compound - Tertiary carboxylic acid amide - Amino acid or derivatives - Carboxamide group - Acetal - Carboxylic acid derivative - Carbonitrile - Nitrile - Oxacycle - Thioether - Sulfenyl compound - Azacycle - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Organic nitrogen compound - Amine - Organosulfur compound - Primary amine - Organic oxide - Hydrocarbon derivative - Organopnictogen compound - Carbonyl group - Cyanide - 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