Compound Identification
SMILES
[N-]=[N+]=N[C@H]1C[C@H](SCC2=CC=CC=C2)S[C@@H]1COC(=O)C1=CC=CC=C1
InChIKey
InChIKey=IVGUWRSYOHXKOF-RCCFBDPRSA-N
Formula
C19H19N3O2S2
Mass
385.5
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
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Class
Benzene and substituted derivatives
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Subclass
Benzoic acids and derivatives
- Level 5 Benzoic acid esters
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Subclass
Benzoic acids and derivatives
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Benzoic acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Benzoic acid esters
Alternative Parents
Benzoyl derivatives Thiolanes Dithioacetals Carboxylic acid esters Azo imides Azo compounds Sulfenyl compounds Dialkylthioethers Organooxygen compounds Organic salts Organic oxides Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Benzoate ester - Benzoyl - Thioacetal - Thiolane - Azo compound - Azo imide - Carboxylic acid ester - Carboxylic acid derivative - Organoheterocyclic compound - Thioether - Dialkylthioether - Sulfenyl compound - Organooxygen compound - Organonitrogen compound - Organic salt - Organic nitrogen compound - Organosulfur compound - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organic cation - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as benzoic acid esters. These are ester derivatives of benzoic acid.
External Descriptors
Not available