Structure Information
Structure

Compound Identification

SMILES

O=C1NC2=C(C=C(C=C2)C2=CSC=C2)C(=O)N2CC(CC12)NS(=O)(=O)C1=CC=CS1

InChIKey

InChIKey=XTOSNYCQXNDKBP-UHFFFAOYSA-N

Formula

C20H17N3O4S3

Mass

459.55

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Benzodiazepines

Subclass

1,4-benzodiazepines

Intermediate Tree Nodes

Not available

Direct Parent

1,4-benzodiazepines

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

1,4-benzodiazepine - Alpha-amino acid or derivatives - Organosulfonic acid amide - Benzenoid - Pyrrolidine - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Sulfonyl - Tertiary carboxylic acid amide - Thiophene - Aminosulfonyl compound - Vinylogous amide - Heteroaromatic compound - Secondary carboxylic acid amide - Carboxamide group - Lactam - Carboxylic acid derivative - Azacycle - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Organonitrogen compound - Organic oxide - Organooxygen compound - Hydrocarbon derivative - Organosulfur compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as 1,4-benzodiazepines. These are organic compounds containing a benzene ring fused to a 1,4-azepine.

External Descriptors

Not available

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