Compound Identification
SMILES
COC1=C(OCC(=O)NC2=CC=C(C)C=C2)C=CC(C=CC2=NC3=C(S2)C=C(C=C3)[N+]([O-])=O)=C1
InChIKey
InChIKey=ATMHTTHRMLPBFV-UHFFFAOYSA-N
Formula
C25H21N3O5S
Mass
475.52
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 Styrenes Phenoxy compounds Anisoles Methoxybenzenes Nitroaromatic compounds N-arylamides Toluenes Alkyl aryl ethers Thiazoles Heteroaromatic compounds Secondary carboxylic acid amides Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organic oxoazanium compounds Carbonyl compounds Organic zwitterions Organic salts Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1,3-benzothiazole - Anilide - Anisole - Phenoxy compound - Nitroaromatic compound - Phenol ether - Styrene - N-arylamide - Methoxybenzene - Alkyl aryl ether - Toluene - Benzenoid - Monocyclic benzene moiety - Heteroaromatic compound - Azole - Thiazole - Organic nitro compound - Secondary carboxylic acid amide - Carboxamide group - C-nitro compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Azacycle - Carboxylic acid derivative - Ether - Organic oxoazanium - Organic salt - Organonitrogen compound - Organooxygen compound - Organic oxide - Carbonyl group - Organic oxygen compound - Hydrocarbon derivative - Organic nitrogen compound - Organic zwitterion - 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