Compound Identification
SMILES
COC1=CC=C(C=C1)N=C(SC1=NC2=CC=CC=C2S1)C1=CC(=CC(=C1)[N+]([O-])=O)[N+]([O-])=O
InChIKey
InChIKey=GVGYTFBTJODSRJ-UHFFFAOYSA-N
Formula
C21H14N4O5S2
Mass
466.49
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Benzothiazoles
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzothiazoles
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Benzothiazoles
Alternative Parents
Nitrobenzenes Methoxyanilines Phenoxy compounds Anisoles Aryl thioethers Nitroaromatic compounds Methoxybenzenes Alkyl aryl ethers Thiazoles Heteroaromatic compounds Imidothioesters Sulfenyl compounds Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Azacyclic compounds Imidothioic acids and derivatives Hydrocarbon derivatives Organic oxides Organic salts Organic zwitterions Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Nitrobenzene - Methoxyaniline - 1,3-benzothiazole - Phenol ether - Phenoxy compound - Methoxybenzene - Aryl thioether - Anisole - Nitroaromatic compound - Alkyl aryl ether - Benzenoid - Monocyclic benzene moiety - Thiazole - Heteroaromatic compound - Azole - Organic nitro compound - C-nitro compound - Imidothioester - Azacycle - Ether - Imidothioic acid or derivatives - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Organic oxoazanium - Allyl-type 1,3-dipolar organic compound - Sulfenyl compound - Organic oxide - Hydrocarbon derivative - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic oxygen compound - Organic zwitterion - Organic salt - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as benzothiazoles. These are organic compounds containing a benzene fused to a thiazole ring (a five-membered ring with four carbon atoms, one nitrogen atom and one sulfur atom).
External Descriptors
Not available