Compound Identification
SMILES
CC1=CC=CC(C(=O)NCCC(N)=O)=C1SC(=O)C1=CC=CC=C1C
InChIKey
InChIKey=BJZKIZMHAVWEEY-UHFFFAOYSA-N
Formula
C19H20N2O3S
Mass
356.44
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
-
Class
Carboxylic acids and derivatives
-
Subclass
Amino acids, peptides, and analogues
-
Level 5
Amino acids and derivatives
- Level 6 Beta amino acids and derivatives
-
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
Direct Parent
Beta amino acids and derivatives
Alternative Parents
O-sulfanylbenzoic acids and derivatives m-Toluamides Thiobenzoic acids and derivatives Benzamides Aryl thioethers Benzoyl derivatives Thioesters Secondary carboxylic acid amides Primary carboxylic acid amides Carbothioic S-esters Sulfenyl compounds Organic oxides Carbonyl compounds Organonitrogen compounds Organopnictogen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Beta amino acid or derivatives - O-sulfanylbenzoic acid or derivatives - Benzamide - Benzoic acid or derivatives - M-toluamide - Toluamide - Thiobenzoic acid or derivatives - Aryl thioether - Benzoyl - Toluene - Monocyclic benzene moiety - Benzenoid - Carboxamide group - Carbothioic s-ester - Primary carboxylic acid amide - Thiocarboxylic acid ester - Secondary carboxylic acid amide - Sulfenyl compound - Thiocarboxylic acid or derivatives - Organonitrogen compound - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organooxygen compound - Organosulfur compound - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as beta amino acids and derivatives. These are amino acids having a (-NH2) group attached to the beta carbon atom.
External Descriptors
Not available