Structure Information
Structure

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

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Benzothiazoles

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Benzothiazoles

Alternative Parents

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

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