Compound Identification
SMILES
CC(=O)C(=CN1C(=S)SC2=CC=CC=C12)C(=O)NC1=CC=C(C=C1)[N+]([O-])=O
InChIKey
InChIKey=AKIFWSLMJSPRGH-UHFFFAOYSA-N
Formula
C18H13N3O4S2
Mass
399.44
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
Anilides Nitrobenzenes N-arylamides Nitroaromatic compounds Alpha-branched alpha,beta-unsaturated ketones Fatty amides Thiazoles Heteroaromatic compounds Acryloyl compounds Enones Vinylogous amides Secondary carboxylic acid amides Ketones Organic oxoazanium compounds Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organic salts Organic oxides Hydrocarbon derivatives Organic zwitterions Organosulfur compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1,3-benzothiazole - Nitrobenzene - Anilide - Nitroaromatic compound - N-arylamide - Monocyclic benzene moiety - Fatty amide - Benzenoid - Alpha-branched alpha,beta-unsaturated-ketone - Fatty acyl - Vinylogous amide - Heteroaromatic compound - Acryloyl-group - Alpha,beta-unsaturated ketone - Enone - Azole - Thiazole - Organic nitro compound - Carboxamide group - Ketone - C-nitro compound - Secondary carboxylic acid amide - Azacycle - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Carboxylic acid derivative - Allyl-type 1,3-dipolar organic compound - Organic oxoazanium - Organic zwitterion - Organic nitrogen compound - Hydrocarbon derivative - Organic salt - Organic oxide - Organic oxygen compound - Carbonyl group - Organonitrogen compound - Organooxygen compound - Organosulfur compound - 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