Compound Identification
SMILES
CSC1=CC=CC=C1C(=O)NC1=NC(=CS1)C1=CC2=C(OCCO2)C=C1
InChIKey
InChIKey=RSJSYPYONJJIDP-UHFFFAOYSA-N
Formula
C19H16N2O3S2
Mass
384.47
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
O-sulfanylbenzoic acids and derivatives
Alternative Parents
Benzo-1,4-dioxanes Benzamides Thiophenol ethers Benzoyl derivatives 2,4-disubstituted thiazoles Alkyl aryl ethers Alkylarylthioethers Vinylogous thioesters Para dioxins Heteroaromatic compounds Secondary carboxylic acid amides Oxacyclic compounds Sulfenyl compounds Azacyclic compounds Hydrocarbon derivatives Organopnictogen compounds Organic oxides Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzo-1,4-dioxane - Benzodioxane - O-sulfanylbenzoic acid or derivatives - Benzamide - Aryl thioether - Benzoyl - Thiophenol ether - 2,4-disubstituted 1,3-thiazole - Alkyl aryl ether - Alkylarylthioether - Vinylogous thioester - Para-dioxin - Azole - Heteroaromatic compound - Thiazole - Carboxamide group - Secondary carboxylic acid amide - Sulfenyl compound - Organoheterocyclic compound - Ether - Carboxylic acid derivative - Azacycle - Oxacycle - Thioether - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as o-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 2, respectively.
External Descriptors
Not available