Compound Identification
SMILES
NC(=N)N1CCC[C@@H](C1)C(=O)NC[C@@H]1CCCN1C(=O)[C@H](CO)NS(=O)(=O)C1=CC2=CC=CC=C2C=C1
InChIKey
InChIKey=JWNJPEKBZMEXIU-ONTIZHBOSA-N
Formula
C25H34N6O5S
Mass
530.64
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
- Class Naphthalenes
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Naphthalenes
Subclass
Naphthalene sulfonic acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
2-naphthalene sulfonic acids and derivatives
Alternative Parents
2-naphthalene sulfonamides Alpha amino acid amides Piperidinecarboxamides N-acylpyrrolidines Organosulfonamides Tertiary carboxylic acid amides Aminosulfonyl compounds Secondary carboxylic acid amides Guanidines Azacyclic compounds Carboximidamides Hydrocarbon derivatives Carbonyl compounds Imines Organic oxides Organopnictogen compounds Primary alcohols
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2-naphthalene sulfonamide - Naphthalene sulfonamide - 2-naphthalene sulfonic acid or derivatives - Alpha-amino acid amide - Alpha-amino acid or derivatives - 3-piperidinecarboxamide - Piperidinecarboxamide - N-acylpyrrolidine - Piperidine - Organosulfonic acid amide - Pyrrolidine - Organic sulfonic acid or derivatives - Aminosulfonyl compound - Tertiary carboxylic acid amide - Sulfonyl - Organosulfonic acid or derivatives - Carboxamide group - Guanidine - Secondary carboxylic acid amide - Carboximidamide - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Primary alcohol - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Alcohol - Imine - Organic nitrogen compound - Organopnictogen compound - Organic oxide - Carbonyl group - Hydrocarbon derivative - Organic oxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 2-naphthalene sulfonic acids and derivatives. These are organic aromatic compounds that contain a naphthalene moiety that carries a sulfonic acid group (or a derivative thereof) at the 2-position. Naphthalene is a bicyclic compound that is made up of two fused benzene ring.
External Descriptors
CHEBI:41142 : piperidinecarboxamide - N-acylpyrrolidine - N-carbamimidoylpiperidine