Structure Information
Structure

Compound Identification

SMILES

CC1=C(NC(=O)CN2CCC(CC2)C2=NC3=CC=CC=C3S2)C=CC(=C1)[N+]([O-])=O

InChIKey

InChIKey=KTXLAKWWYGCBNA-UHFFFAOYSA-N

Formula

C21H22N4O3S

Mass

410.49

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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 amides

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Alpha-amino acid amide - 1,3-benzothiazole - Nitrobenzene - Anilide - Nitrotoluene - Nitroaromatic compound - N-arylamide - Aralkylamine - Toluene - Monocyclic benzene moiety - Piperidine - Benzenoid - Heteroaromatic compound - Azole - Thiazole - Organic nitro compound - Carboxamide group - C-nitro compound - Secondary carboxylic acid amide - Tertiary amine - Tertiary aliphatic amine - Organoheterocyclic compound - Azacycle - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organic oxoazanium - Hydrocarbon derivative - Organonitrogen compound - Amine - Organic oxide - Organic oxygen compound - Carbonyl group - Organic salt - Organic nitrogen compound - Organooxygen compound - Organic zwitterion - Aromatic heteropolycyclic compound

Description

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

External Descriptors

Not available

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