Structure Information
Structure

Compound Identification

SMILES

CC1=C(SC=C1)C(=O)CN1C2=CC=CC=C2C(=NC(NC(=O)NC2=CC=CC(C)=C2)C1=O)C1=CC=CC=C1

InChIKey

InChIKey=XAHDPRSSHMTXGU-UHFFFAOYSA-N

Formula

C30H26N4O3S

Mass

522.62

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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 - N-phenylurea - Aryl ketone - Aryl alkyl ketone - Toluene - Monocyclic benzene moiety - Benzenoid - Tertiary carboxylic acid amide - Thiophene - Heteroaromatic compound - Carboxamide group - Ketimine - Ketone - Lactam - Urea - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Carboxylic acid derivative - Azacycle - Organooxygen compound - Organonitrogen compound - Organic oxide - Carbonyl group - Imine - Organic nitrogen compound - Hydrocarbon derivative - Organic oxygen 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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