Compound Identification
SMILES
CO\N=C(/C(=O)N[C@H]1[C@H]2SCC(\C=C\C[N+]3(C)C[C@H](O)C[C@H]3CO)=C(C2C1=O)C([O-])=O)C1=NSC(N)=N1
InChIKey
InChIKey=MLJBCTRIRYKJMH-MNLAQPKISA-N
Formula
C22H28N6O7S2
Mass
552.62
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Thiopyrans
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Thiopyrans
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Thiopyrans
Alternative Parents
N-alkylpyrrolidines Thiadiazoles Tetraalkylammonium salts Heteroaromatic compounds Secondary carboxylic acid amides Secondary alcohols 1,2-aminoalcohols Amino acids Carboxylic acid salts Ketones Azacyclic compounds Carboxylic acids Dialkylthioethers Monocarboxylic acids and derivatives Primary amines Primary alcohols Organic salts Hydrocarbon derivatives Organic oxides Organic zwitterions
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Thiopyran - N-alkylpyrrolidine - Azole - Pyrrolidine - Quaternary ammonium salt - Tetraalkylammonium salt - Thiadiazole - Heteroaromatic compound - 1,2-aminoalcohol - Amino acid or derivatives - Carboxamide group - Carboxylic acid salt - Ketone - Secondary alcohol - Secondary carboxylic acid amide - Amino acid - Dialkylthioether - Azacycle - Thioether - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Organonitrogen compound - Organic zwitterion - Hydrocarbon derivative - Alcohol - Organic salt - Carbonyl group - Amine - Organooxygen compound - Primary alcohol - Primary amine - Organic oxygen compound - Organic oxide - Organic nitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as thiopyrans. These are compounds containing a six-member aliphatic heterocycle made up of one sulfur atom and five carbon atoms.
External Descriptors
Not available