Structure Information
Structure

Compound Identification

SMILES

CC(=O)NC[C@H]1CN(C(=O)O1)C1=CC(F)=C(C=C1)N1CC2=CN(CCO)N=C2C1

InChIKey

InChIKey=GYIJJLFUDOERAQ-HNNXBMFYSA-N

Formula

C19H22FN5O4

Mass

403.414

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Pyrrolopyrazoles

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Pyrrolopyrazoles

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Pyrrolopyrazole - Tertiary aliphatic/aromatic amine - Dialkylarylamine - Aniline or substituted anilines - Fluorobenzene - Halobenzene - Aralkylamine - Oxazolidinone - Benzenoid - Monocyclic benzene moiety - Aryl halide - Aryl fluoride - Heteroaromatic compound - Acetamide - Pyrazole - Carbamic acid ester - Oxazolidine - Pyrrole - Azole - Amino acid or derivatives - Carboxamide group - Tertiary amine - Secondary carboxylic acid amide - Alkanolamine - Carboxylic acid derivative - Oxacycle - Azacycle - Primary alcohol - Organohalogen compound - Organofluoride - Organonitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organooxygen compound - Amine - Alcohol - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as pyrrolopyrazoles. These are polycyclic aromatic compounds containing a pyrrole fused to a pyrazole ring. Pyrrole is 5-membered ring consisting of four carbon atoms and one nitrogen atom. Pyrazole is a 5-membered ring consisting of three carbon atoms and two adjacent nitrogen centers.

External Descriptors

Not available

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