Structure Information
Structure

Compound Identification

SMILES

CC1=C(NC(=O)[C@@H]2CCC(=O)N2)C=C(NC2=NC=C(C=N2)C2=CC=C(OC(F)(F)F)C=C2)C=C1

InChIKey

InChIKey=XTRATDQTTFCNSE-SFHVURJKSA-N

Formula

C23H20F3N5O3

Mass

471.44

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organic acids and derivatives

Class

Carboxylic acids and derivatives

Subclass

Amino acids, peptides, and analogues

Intermediate Tree Nodes

Amino acids and derivatives - Alpha amino acids and derivatives

Direct Parent

Proline and derivatives

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Proline or derivatives - Alpha-amino acid amide - 5-phenylpyrimidine - Anilide - Diaminotoluene - Phenoxy compound - Phenol ether - Pyrrolidine carboxylic acid or derivatives - Pyrrolidine-2-carboxamide - N-arylamide - Aniline or substituted anilines - Aminopyrimidine - Toluene - Monocyclic benzene moiety - Pyrimidine - Pyrrolidone - 2-pyrrolidone - Benzenoid - Pyrrolidine - Heteroaromatic compound - Secondary carboxylic acid amide - Carboxamide group - Trihalomethane - Lactam - Secondary amine - Organoheterocyclic compound - Azacycle - Amine - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Organic oxide - Alkyl halide - Carbonyl group - Alkyl fluoride - Halomethane - Hydrocarbon derivative - Organic nitrogen compound - Organic oxygen compound - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as proline and derivatives. These are compounds containing proline or a derivative thereof resulting from reaction of proline at the amino group or the carboxy group, or from the replacement of any hydrogen of glycine by a heteroatom.

External Descriptors

Not available

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