Compound Identification
SMILES
CCCN1C(CSC(C)=O)CC2=C(C)C(=C(C)C(NC(=O)C(C)(C)C)=C12)[N+]([O-])=O
InChIKey
InChIKey=NPJYWABUKOIFBP-UHFFFAOYSA-N
Formula
C21H31N3O4S
Mass
421.56
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Indoles and derivatives
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Indoles and derivatives
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Indoles and derivatives
Alternative Parents
Nitroaromatic compounds N-arylamides Dialkylarylamines Aralkylamines Benzenoids Thioesters Secondary carboxylic acid amides Amino acids and derivatives Carbothioic S-esters Sulfenyl compounds Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organic salts Organic zwitterions
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Indole or derivatives - Nitroaromatic compound - Dialkylarylamine - Tertiary aliphatic/aromatic amine - N-arylamide - Aralkylamine - Benzenoid - Amino acid or derivatives - Carboxamide group - C-nitro compound - Secondary carboxylic acid amide - Organic nitro compound - Carbothioic s-ester - Tertiary amine - Thiocarboxylic acid ester - Carboxylic acid derivative - Organic oxoazanium - Azacycle - Organic 1,3-dipolar compound - Thiocarboxylic acid or derivatives - Propargyl-type 1,3-dipolar organic compound - Sulfenyl compound - Allyl-type 1,3-dipolar organic compound - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Organic salt - Carbonyl group - Organic oxygen compound - Amine - Organic oxide - Hydrocarbon derivative - Organic zwitterion - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as indoles and derivatives. These are organic compounds containing an indole, which is a bicyclic ring system made up of a six-membered benzene ring fused to a five-membered nitrogen-containing pyrrole ring.
External Descriptors
Not available