Compound Identification
SMILES
CC1=CC=C(NC(=O)CN2C(=O)SC(=CC3=CC=C(I)C=C3)C2=O)C=C1
InChIKey
InChIKey=CQJWRKAULYVVNF-UHFFFAOYSA-N
Formula
C19H15IN2O3S
Mass
478.3
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
-
Class
Carboxylic acids and derivatives
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Subclass
Amino acids, peptides, and analogues
- Level 5 Amino acids and derivatives
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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
Alpha amino acids and derivatives
Alternative Parents
Anilides N-arylamides Toluenes Thiazolidinediones Iodobenzenes Aryl iodides Dicarboximides Thiocarbamic acid derivatives Secondary carboxylic acid amides Organic carbonic acids and derivatives Azacyclic compounds Hydrocarbon derivatives Organopnictogen compounds Carbonyl compounds Organoiodides Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Alpha-amino acid or derivatives - Anilide - N-arylamide - Halobenzene - Iodobenzene - Toluene - Thiazolidinedione - Aryl halide - Aryl iodide - Monocyclic benzene moiety - Benzenoid - Dicarboximide - Thiazolidine - Carboxamide group - Carbonic acid derivative - Secondary carboxylic acid amide - Thiocarbamic acid derivative - Organoheterocyclic compound - Azacycle - Organoiodide - Organohalogen compound - Hydrocarbon derivative - Organic nitrogen compound - Carbonyl group - Organic oxide - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Organopnictogen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as alpha amino acids and derivatives. These are amino acids in which the amino group is attached to the carbon atom immediately adjacent to the carboxylate group (alpha carbon), or a derivative thereof.
External Descriptors
Not available