Compound Identification
SMILES
CSC1=CC=CC(NC(=O)C(NS(=O)(=O)C2=CC3=C(C=C2)N(CC3)C(C)=O)C(C)C)=C1
InChIKey
InChIKey=NVGWTBPSISYKPB-UHFFFAOYSA-N
Formula
C22H27N3O4S2
Mass
461.6
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
Alpha amino acids and derivatives
- Level 7 Valine and derivatives
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Level 6
Alpha 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 - Alpha amino acids and derivatives
Direct Parent
Valine and derivatives
Alternative Parents
Alpha amino acid amides Anilides Indoles and derivatives Thiophenol ethers N-arylamides Alkylarylthioethers Fatty amides Organosulfonamides Acetamides Aminosulfonyl compounds Tertiary carboxylic acid amides Secondary carboxylic acid amides Azacyclic compounds Sulfenyl compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Valine or derivatives - Alpha-amino acid amide - Indole or derivatives - Anilide - Aryl thioether - Thiophenol ether - N-arylamide - Alkylarylthioether - Monocyclic benzene moiety - Fatty amide - Organosulfonic acid amide - Fatty acyl - Benzenoid - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Sulfonyl - Tertiary carboxylic acid amide - Acetamide - Aminosulfonyl compound - Secondary carboxylic acid amide - Carboxamide group - Azacycle - Thioether - Sulfenyl compound - Organoheterocyclic compound - Organic oxygen compound - Organic nitrogen compound - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Carbonyl group - Organic oxide - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as valine and derivatives. These are compounds containing valine or a derivative thereof resulting from reaction of valine at the amino group or the carboxy group, or from the replacement of any hydrogen of glycine by a heteroatom.
External Descriptors
Not available