Structure Information
Structure

Compound Identification

SMILES

COC(=O)CNC(=O)CNC(=O)CSC1=NN=C(COC2=CC=C(Cl)C=C2)N1C1=CC=CC=C1

InChIKey

InChIKey=BTZSPDKTAULBHA-UHFFFAOYSA-N

Formula

C22H22ClN5O5S

Mass

503.96

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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

Not available

Direct Parent

Peptides

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Alpha peptide - Alpha-amino acid ester - N-acyl-alpha amino acid or derivatives - Alpha-amino acid amide - Phenyl-1,2,4-triazole - Phenyltriazole - N-substituted-alpha-amino acid - Alpha-amino acid or derivatives - Phenoxy compound - Aryl thioether - Phenol ether - Alkyl aryl ether - Halobenzene - Alkylarylthioether - Chlorobenzene - Aryl chloride - Aryl halide - Benzenoid - Monocyclic benzene moiety - Methyl ester - Heteroaromatic compound - Triazole - 1,2,4-triazole - Azole - Carboxamide group - Carboxylic acid ester - Secondary carboxylic acid amide - Azacycle - Monocarboxylic acid or derivatives - Organoheterocyclic compound - Ether - Sulfenyl compound - Thioether - Organonitrogen compound - Organic nitrogen compound - Carbonyl group - Organic oxygen compound - Organopnictogen compound - Organosulfur compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organohalogen compound - Organochloride - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as peptides. These are compounds containing an amide derived from two or more amino carboxylic acid molecules (the same or different) by formation of a covalent bond from the carbonyl carbon of one to the nitrogen atom of another.

External Descriptors

Not available

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