Compound Identification
SMILES
CN1C(SC2=C1C=C(C=C2)[N+]([O-])=O)=CC=C1SC(N(C1=O)C1=CC=CC=C1)=C1SC(=S)N(C1=O)C1=CC=CC=C1
InChIKey
InChIKey=XGVNAMDXPJGFHE-UHFFFAOYSA-N
Formula
C28H18N4O4S4
Mass
602.72
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
Aryl thioethers Nitroaromatic compounds Thiazolidinethiones Benzene and substituted derivatives Vinylogous amides Thiazoles Heteroaromatic compounds Ketene acetals Lactams Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Carboxylic acids and derivatives Organic oxoazanium compounds Amines Carbonyl compounds Organic salts Hydrocarbon derivatives Organic oxides Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzo-thiazole - 1,2-benzothiazole - 1,3-benzothiazole - Aryl thioether - Nitroaromatic compound - Monocyclic benzene moiety - Thiazolidinethione - Benzenoid - Azole - Thiazole - Thiazolidine - Heteroaromatic compound - Vinylogous amide - Organic nitro compound - Ketene acetal or derivatives - Lactam - C-nitro compound - Allyl-type 1,3-dipolar organic compound - Azacycle - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Carboxylic acid derivative - Organic oxoazanium - Organic oxygen compound - Organic salt - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Amine - Organic nitrogen compound - Organic cation - 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