Compound Identification
SMILES
COC(=O)[C@@]1(O[C@H](S[C@]11SC(=NC11CCCC1)C1=CC=CC=C1)C1=CC=CC=C1)C#N
InChIKey
InChIKey=FHSOOFFBAJIRQW-QDSKXPNFSA-N
Formula
C24H22N2O3S2
Mass
450.57
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organosulfur compounds
-
Class
Thioacetals
-
Subclass
Dithioacetals
- Level 5 Dithioketals
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Subclass
Dithioacetals
-
Class
Thioacetals
-
Superclass
Organosulfur compounds
Kingdom
Organic compounds
Superclass
Organosulfur compounds
Class
Thioacetals
Subclass
Dithioacetals
Intermediate Tree Nodes
Not available
Direct Parent
Dithioketals
Alternative Parents
Imidothiolactones Benzene and substituted derivatives Thiazolines Oxathiolanes Monothioacetals Methyl esters Propargyl-type 1,3-dipolar organic compounds Oxacyclic compounds Nitriles Monocarboxylic acids and derivatives Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Dithioketal - Monocyclic benzene moiety - Benzenoid - Imidothiolactone - Monothioacetal - Oxathiolane - Meta-thiazoline - Methyl ester - Carboxylic acid ester - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Carbonitrile - Nitrile - Oxacycle - Azacycle - Organoheterocyclic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxygen compound - Cyanide - Organic nitrogen compound - Organic oxide - Carbonyl group - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as dithioketals. These are compounds containing a dithioketal functional group with the general structure R2C(SR')2 with R, R' = organyl.
External Descriptors
Not available