Compound Identification
SMILES
CCOC1=CC2=C(C=C1)N=C(NC(=O)C(NS(=O)(=O)C1=CC=CC3=NSN=C13)C(C)C)S2
InChIKey
InChIKey=SVLXQEGZXIWOFB-UHFFFAOYSA-N
Formula
C20H21N5O4S3
Mass
491.6
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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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
-
Level 6
Alpha amino acids and derivatives
- Level 7 Valine and derivatives
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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
Valine and derivatives
Alternative Parents
Alpha amino acid amides Benzothiadiazoles Benzothiazoles Phenol ethers N-arylamides Alkyl aryl ethers Organosulfonamides Fatty amides Heteroaromatic compounds Thiadiazoles Thiazoles Aminosulfonyl compounds Secondary carboxylic acid amides Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Valine or derivatives - Alpha-amino acid amide - 2,1,3-benzothiadiazole - 1,3-benzothiazole - Phenol ether - N-arylamide - Alkyl aryl ether - Fatty amide - Organosulfonic acid amide - Benzenoid - Fatty acyl - Aminosulfonyl compound - Thiazole - Thiadiazole - Sulfonyl - Azole - Organosulfonic acid or derivatives - Heteroaromatic compound - Organic sulfonic acid or derivatives - Secondary carboxylic acid amide - Carboxamide group - Azacycle - Organoheterocyclic compound - Ether - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organosulfur compound - Organonitrogen compound - Organooxygen compound - 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