Compound Identification
SMILES
C[N+](O)([O-])OSC1=CC=CC(=C1)C(=O)NCNS(C)(=O)=O
InChIKey
InChIKey=ZGJQSXJUYKOUMN-UHFFFAOYSA-N
Formula
C10H15N3O6S2
Mass
337.37
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Benzoic acids and derivatives
Intermediate Tree Nodes
Sulfanylbenzoic acids and derivatives
Direct Parent
M-sulfanylbenzoic acids and derivatives
Alternative Parents
Benzamides Benzoyl derivatives Organosulfonamides Organic sulfonamides Azonic acids and derivatives Aminosulfonyl compounds Secondary carboxylic acid amides Sulfenyl compounds N-organohydroxylamines Organooxygen compounds Organic zwitterions Organic salts Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
M-sulfanylbenzoic acid or derivatives - Benzamide - Benzoyl - Organic sulfonic acid amide - Organosulfonic acid amide - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Azonic acid or derivatives - Aminosulfonyl compound - Sulfonyl - Carboxamide group - Secondary carboxylic acid amide - N-organohydroxylamine - Carboxylic acid derivative - Sulfenyl compound - Organic salt - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic oxide - Hydrocarbon derivative - Organic oxygen compound - Organic nitrogen compound - Organic zwitterion - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as m-sulfanylbenzoic acids and derivatives. These are benzoic acids (or derivatives) which bear a sulfanyl group (R-SH) attached to the benzene ring at positions 1 and 3, respectively.
External Descriptors
Not available