Compound Identification
SMILES
COCCNC(=O)C1=C(NC(=O)C[NH+](C)CC2=CC=CC=C2)SC2=C1CCCC2
InChIKey
InChIKey=NXBSPJNUUAYMQG-UHFFFAOYSA-O
Formula
C22H30N3O3S
Mass
416.56
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organic acids and derivatives
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Class
Carboxylic acids and derivatives
-
Subclass
Amino acids, peptides, and analogues
-
Level 5
Amino acids and derivatives
-
Level 6
Alpha amino acids and derivatives
- Level 7 Alpha amino acid amides
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Level 6
Alpha amino acids and derivatives
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Level 5
Amino acids and derivatives
-
Subclass
Amino acids, peptides, and analogues
-
Class
Carboxylic acids and derivatives
-
Superclass
Organic acids and derivatives
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
Thiophene carboxamides Phenylmethylamines N-arylamides Benzylamines Aralkylamines Vinylogous amides Quaternary ammonium salts Heteroaromatic compounds Trialkylamines Secondary carboxylic acid amides Dialkyl ethers Organic oxides Hydrocarbon derivatives Carbonyl compounds Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-amino acid amide - Benzylamine - Phenylmethylamine - Thiophene carboxamide - Thiophene carboxylic acid or derivatives - N-arylamide - Aralkylamine - Monocyclic benzene moiety - Benzenoid - Quaternary ammonium salt - Heteroaromatic compound - Thiophene - Vinylogous amide - Tertiary aliphatic amine - Tertiary amine - Secondary carboxylic acid amide - Carboxamide group - Organoheterocyclic compound - Dialkyl ether - Ether - Organic oxygen compound - Amine - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic nitrogen compound - Carbonyl group - Organic oxide - Organic cation - 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