Compound Identification
SMILES
CC1=CC=C(C=C1)N1C(=O)N=C2SC(=NN2C1=O)C1=CC2=C(OCO2)C=C1
InChIKey
InChIKey=LLBCMZJNTHQLRU-UHFFFAOYSA-N
Formula
C18H12N4O4S
Mass
380.38
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
Triazinones Toluenes 1,3,5-triazines Thiadiazoles Heteroaromatic compounds Oxacyclic compounds Azacyclic compounds Acetals Organopnictogen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzodioxole - Toluene - Triazinone - Monocyclic benzene moiety - Triazine - Benzenoid - 1,3,5-triazine - Azole - Thiadiazole - Heteroaromatic compound - Acetal - Oxacycle - Azacycle - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Organic nitrogen compound - 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