Structure Information
Structure

Compound Identification

SMILES

CC1=NC(=CS1)C(=O)N1C(C2=C(F)C=C(OCC3=CC=CC=C3)C=C2)C2=C(CC(C)(C)CC2=O)NC2=C1C=CC=C2O

InChIKey

InChIKey=GYIGAWCRGDXXOJ-UHFFFAOYSA-N

Formula

C33H30FN3O4S

Mass

583.68

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Benzodiazepines

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Benzodiazepines

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Benzodiazepine - 2-heteroaryl carboxamide - Phenol ether - Phenoxy compound - Thiazolecarboxamide - Thiazolecarboxylic acid or derivatives - Phenol - Para-diazepine - Halobenzene - 1-hydroxy-4-unsubstituted benzenoid - Alkyl aryl ether - Cyclohexenone - 2,4-disubstituted 1,3-thiazole - Fluorobenzene - 1-hydroxy-2-unsubstituted benzenoid - Aryl halide - Aryl fluoride - Benzenoid - Monocyclic benzene moiety - Heteroaromatic compound - Azole - Vinylogous amide - Thiazole - Tertiary carboxylic acid amide - Ketone - Amino acid or derivatives - Tertiary amine - Carboxamide group - Azacycle - Ether - Carboxylic acid derivative - Enamine - Organic oxide - Amine - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organohalogen compound - Carbonyl group - Organooxygen compound - Organonitrogen compound - Organofluoride - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as benzodiazepines. These are organic compounds containing a benzene ring fused to either isomers of diazepine(unsaturated seven-member heterocycle with two nitrogen atoms replacing two carbon atoms).

External Descriptors

Not available

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