Compound Identification
SMILES
CCNC(=O)C1=CC=CC=C1S(C)=O
InChIKey
InChIKey=PWBWOJDNAURSGN-UHFFFAOYSA-N
Formula
C10H13NO2S
Mass
211.28
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
Phenyl sulfoxides Benzamides Benzoyl derivatives Sulfoxides Secondary carboxylic acid amides Sulfinyl compounds Organooxygen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
O-sulfanylbenzoic acid or derivatives - Benzamide - Phenyl sulfoxide - Benzoyl - Carboxamide group - Sulfoxide - Secondary carboxylic acid amide - Carboxylic acid derivative - Sulfinyl compound - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Organosulfur compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Aromatic homomonocyclic 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