Compound Identification
SMILES
O=S1(=O)N=C(OCC2=CC=CC=C2)C2=CC=CC=C2N1CC1=CC=C(C=C1)C#N
InChIKey
InChIKey=IVQUDEQGOWNYOY-UHFFFAOYSA-N
Formula
C22H17N3O3S
Mass
403.46
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Thiadiazines
- Subclass Benzothiadiazines
-
Class
Thiadiazines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Thiadiazines
Subclass
Benzothiadiazines
Intermediate Tree Nodes
Not available
Direct Parent
Benzothiadiazines
Alternative Parents
Benzonitriles Organic sulfuric acids and derivatives Nitriles Azacyclic compounds Organopnictogen compounds Organooxygen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzothiadiazine - Benzonitrile - Monocyclic benzene moiety - Benzenoid - Organic sulfuric acid or derivatives - Carbonitrile - Nitrile - Azacycle - Organic nitrogen compound - Organonitrogen compound - Organooxygen 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 benzothiadiazines. These are organic compounds containing a benzene fused to a thiadiazine ring (a six-member ring with two nitrogen atoms and a sulfur atom).
External Descriptors
Not available