Compound Identification
SMILES
CCNC1=C(C=C(C=C1)C#N)N=C1S\C(C(=O)N1CC1=CC=CC=C1)=C1/SC2=C(C=C(NCCN3CCOCC3)C=C2)N1C
InChIKey
InChIKey=DPAVKYYJIYIVPV-DDKHWPGWSA-N
Formula
C33H35N7O2S2
Mass
625.81
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
Phenylalkylamines Aniline and substituted anilines Aryl thioethers Benzonitriles Secondary alkylarylamines Vinylogous thioesters Morpholines Vinylogous amides Thiazolidines Thiazoles Trialkylamines Amino acids and derivatives Isothioureas Propargyl-type 1,3-dipolar organic compounds Oxacyclic compounds Azacyclic compounds Dialkyl ethers Nitriles Carbonyl compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1,3-benzothiazole - 1,2-benzothiazole - Benzo-thiazole - Aniline or substituted anilines - Phenylalkylamine - Aryl thioether - Benzonitrile - Secondary aliphatic/aromatic amine - Vinylogous thioester - Morpholine - Oxazinane - Benzenoid - Monocyclic benzene moiety - Vinylogous amide - Thiazole - Thiazolidine - Isothiourea - Tertiary amine - Tertiary aliphatic amine - Amino acid or derivatives - Oxacycle - Carboxylic acid derivative - Dialkyl ether - Ether - Azacycle - Organic 1,3-dipolar compound - Carbonitrile - Nitrile - Propargyl-type 1,3-dipolar organic compound - Secondary amine - Organic oxygen compound - Cyanide - Organic oxide - Hydrocarbon derivative - Amine - Organonitrogen compound - Organooxygen compound - Carbonyl group - Organic nitrogen 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