Structure Information
Structure

Compound Identification

SMILES

CN1C=C(NC(=O)C2=CC(NC(=O)C3=CC(=CN3C)C3=CC4=NSN=C4C=C3)=CN2C)C=C1C(=O)NCCN1CCOCC1

InChIKey

InChIKey=NHTKOENAFQUOPX-UHFFFAOYSA-N

Formula

C30H33N9O4S

Mass

615.71

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Benzothiadiazoles

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Benzothiadiazoles

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

2,1,3-benzothiadiazole - 2-heteroaryl carboxamide - Pyrrole-2-carboxamide - Pyrrole-2-carboxylic acid or derivatives - Morpholine - N-methylpyrrole - Oxazinane - Substituted pyrrole - Benzenoid - Heteroaromatic compound - Thiadiazole - Pyrrole - Azole - Tertiary aliphatic amine - Carboxamide group - Amino acid or derivatives - Tertiary amine - Secondary carboxylic acid amide - Oxacycle - Ether - Dialkyl ether - Carboxylic acid derivative - Azacycle - Organooxygen compound - Organonitrogen compound - Amine - Hydrocarbon derivative - Organic oxygen compound - Organic oxide - Organic nitrogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as benzothiadiazoles. These are heterocyclic aromatic compounds containing a benzene ring fused to a thiadiazole ring. Thiadiazole is a five-membered aromatic heterocycle made up of one sulfur atom and two nitrogen atoms.

External Descriptors

Not available

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