Structure Information
Structure

Compound Identification

SMILES

COC1=CC=C(C=C1)S(=O)(=O)NC(CNC(=O)C1=CC(F)=C(C=C1)N1CCCC(C1)NC1=NC=CC=N1)C(=O)OC(C)(C)C

InChIKey

InChIKey=ZRXOZGHQSDIWHM-UHFFFAOYSA-N

Formula

C30H37FN6O6S

Mass

628.72

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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

Alpha amino acid esters

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Alpha-amino acid ester - Phenylpiperidine - Aminobenzamide - Aminobenzoic acid or derivatives - Benzenesulfonamide - 3-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Benzenesulfonyl group - Benzamide - Benzoic acid or derivatives - Methoxybenzene - Aniline or substituted anilines - Dialkylarylamine - Anisole - Tertiary aliphatic/aromatic amine - Benzoyl - Phenol ether - Phenoxy compound - 3-aminopiperidine - Halobenzene - Aminopyrimidine - Alkyl aryl ether - Fluorobenzene - Pyrimidine - Piperidine - Monocyclic benzene moiety - Organosulfonic acid amide - Aryl halide - Aryl fluoride - Benzenoid - Heteroaromatic compound - Aminosulfonyl compound - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Tertiary amine - Carboxylic acid ester - Carboxamide group - Secondary carboxylic acid amide - Monocarboxylic acid or derivatives - Organoheterocyclic compound - Ether - Azacycle - Hydrocarbon derivative - Organonitrogen compound - Organofluoride - Organic nitrogen compound - Organic oxide - Organohalogen compound - Organooxygen compound - Organic oxygen compound - Amine - Carbonyl group - Organosulfur compound - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as alpha amino acid esters. These are ester derivatives of alpha amino acids.

External Descriptors

Not available

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