Structure Information
Structure

Compound Identification

SMILES

CSC[C@H](NC(=O)CCC1=CNC2=CC=CC=C12)C(=O)NCCC#N

InChIKey

InChIKey=XZJXOXDNIDBXSU-INIZCTEOSA-N

Formula

C18H22N4O2S

Mass

358.46

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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

N-acyl-alpha amino acids and derivatives

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

N-acyl-alpha amino acid or derivatives - Alpha-amino acid amide - Cysteine or derivatives - Triptan - 3-alkylindole - Indole - Indole or derivatives - Fatty amide - Fatty acyl - Benzenoid - Substituted pyrrole - Heteroaromatic compound - Pyrrole - Carboxamide group - Secondary carboxylic acid amide - Azacycle - Carbonitrile - Nitrile - Organoheterocyclic compound - Dialkylthioether - Sulfenyl compound - Thioether - Carbonyl group - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic oxygen compound - Cyanide - Organic oxide - Hydrocarbon derivative - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as n-acyl-alpha amino acids and derivatives. These are compounds containing an alpha amino acid (or a derivative thereof) which bears an acyl group at its terminal nitrogen atom.

External Descriptors

Not available

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