Compound Identification
SMILES
CCN(CC)C1=CC(C)=C(C=C1)N=C1SC(C(=O)N1C1=CC=C(C)C=C1)=C1SC2=C(C=C(Cl)C=C2)N1C
InChIKey
InChIKey=VEOCHXQHBNIAOC-UHFFFAOYSA-N
Formula
C29H29ClN4OS2
Mass
549.15
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
Aminotoluenes Aniline and substituted anilines Dialkylarylamines Aryl thioethers Vinylogous thioesters Aryl chlorides Vinylogous amides Thiazolidines Thiazoles Amino acids and derivatives Isothioureas Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Hydrocarbon derivatives Organic oxides Carbonyl compounds Organochlorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzo-thiazole - 1,2-benzothiazole - 1,3-benzothiazole - Aryl thioether - Tertiary aliphatic/aromatic amine - Dialkylarylamine - Aniline or substituted anilines - Aminotoluene - Toluene - Aryl chloride - Benzenoid - Vinylogous thioester - Aryl halide - Monocyclic benzene moiety - Vinylogous amide - Thiazolidine - Thiazole - Tertiary amine - Amino acid or derivatives - Isothiourea - Azacycle - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Carboxylic acid derivative - Organic oxide - Organohalogen compound - Carbonyl group - Organic oxygen compound - Amine - Organic nitrogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - 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