Compound Identification
SMILES
O=C1[C@H](CCN1CCNC1=CC=NC=C1)NS(=O)(=O)C1=CC=C(S1)C1=CC=NC=C1
InChIKey
InChIKey=WQUMQKDHQHWSSX-KRWDZBQOSA-N
Formula
C20H21N5O3S2
Mass
443.54
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
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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
Secondary alkylarylamines Aminopyridines and derivatives 2,5-disubstituted thiophenes Pyrrolidine-2-ones Organosulfonamides N-alkylpyrrolidines Tertiary carboxylic acid amides Heteroaromatic compounds Aminosulfonyl compounds Tertiary amines Lactams Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Alpha-amino acid or derivatives - Aminopyridine - Secondary aliphatic/aromatic amine - 2,5-disubstituted thiophene - Pyridine - Pyrrolidone - 2-pyrrolidone - Organosulfonic acid amide - N-alkylpyrrolidine - Pyrrolidine - Heteroaromatic compound - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Sulfonyl - Tertiary carboxylic acid amide - Thiophene - Aminosulfonyl compound - Tertiary amine - Carboxamide group - Lactam - Secondary amine - Azacycle - Organoheterocyclic compound - Amine - Hydrocarbon derivative - Organic nitrogen compound - Organic oxide - Organosulfur compound - Organooxygen compound - Organic oxygen compound - Carbonyl group - Organonitrogen 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