Structure Information
Structure

Compound Identification

SMILES

CS(=O)(=O)N[C@H](CCC1CCNCC1)C(=O)N1C[C@@H](C[C@H]1C(=O)N[C@@H](CC#N)C(=O)C1=NC2=CC=CC=C2O1)OCC1=CC=C(Cl)C=C1

InChIKey

InChIKey=BHEYINVZXMMOMP-NXBJLNSTSA-N

Formula

C33H39ClN6O7S

Mass

699.22

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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

Peptides

Direct Parent

Dipeptides

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Alpha-dipeptide - Proline or derivatives - Alpha-amino acid amide - Alpha-amino acid or derivatives - Benzoxazole - Benzylether - Pyrrolidine-2-carboxamide - Pyrrolidine carboxylic acid or derivatives - N-acylpyrrolidine - Aryl ketone - Aryl alkyl ketone - Chlorobenzene - Halobenzene - Benzenoid - Monocyclic benzene moiety - Piperidine - Aryl halide - Organosulfonic acid amide - Organic sulfonic acid amide - Aryl chloride - Azole - Heteroaromatic compound - Aminosulfonyl compound - Oxazole - Tertiary carboxylic acid amide - Sulfonyl - Organosulfonic acid or derivatives - Pyrrolidine - Organic sulfonic acid or derivatives - Secondary carboxylic acid amide - Amino acid or derivatives - Carboxamide group - Ketone - Secondary amine - Oxacycle - Nitrile - Carbonitrile - Organoheterocyclic compound - Ether - Secondary aliphatic amine - Dialkyl ether - Azacycle - Hydrocarbon derivative - Amine - Carbonyl group - Organohalogen compound - Organic oxygen compound - Organosulfur compound - Organochloride - Cyanide - Organic oxide - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as dipeptides. These are organic compounds containing a sequence of exactly two alpha-amino acids joined by a peptide bond.

External Descriptors

Not available

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