Structure Information
Structure

Compound Identification

SMILES

FC(F)(F)C1=CC=CC(CN2CCN3C(CCNC(=O)C4=COC=C4)=NN=C3CC2)=C1

InChIKey

InChIKey=SIDBYTJAFSKDGB-UHFFFAOYSA-N

Formula

C21H22F3N5O2

Mass

433.435

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Triazolodiazepines

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Triazolodiazepines

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Trifluoromethylbenzene - Triazolo-para-diazepine - Furoic acid or derivatives - Furan-3-carboxylic acid or derivatives - Benzylamine - Phenylmethylamine - Para-diazepine - Aralkylamine - Monocyclic benzene moiety - Benzenoid - Azole - Heteroaromatic compound - Furan - 1,2,4-triazole - Amino acid or derivatives - Carboxamide group - Secondary carboxylic acid amide - Tertiary amine - Tertiary aliphatic amine - Oxacycle - Carboxylic acid derivative - Azacycle - Organonitrogen compound - Organofluoride - Organohalogen compound - Alkyl fluoride - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organooxygen compound - Alkyl halide - Amine - Organic nitrogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as triazolodiazepines. These are heterocyclic aromatic compounds containing a triazole ring fused to a diazepine ring. Triazole is a five-membered ring consisting of two carbon atoms and three nitrogen atoms. Diazepine is a 7-membered ring consisting of five carbon and two nitrogen atoms.

External Descriptors

Not available

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