Compound Identification
SMILES
[Cl-].CC[NH+](CC)CCSC(=O)C1=CC=C(N)C=C1
InChIKey
InChIKey=UCJCCFMUYGVNNA-UHFFFAOYSA-N
Formula
C13H21ClN2OS
Mass
288.83
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- 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
Aminobenzoic acids and derivatives
Alternative Parents
Thiobenzoic acids and derivatives Benzoyl derivatives Aniline and substituted anilines Trialkylamines Thioesters Carbothioic S-esters Amino acids and derivatives Sulfenyl compounds Primary amines Organopnictogen compounds Organooxygen compounds Organic oxides Organic chloride salts Hydrocarbon derivatives
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Aminobenzoic acid or derivatives - Thiobenzoic acid or derivatives - Benzoyl - Aniline or substituted anilines - Amino acid or derivatives - Tertiary amine - Thiocarboxylic acid ester - Tertiary aliphatic amine - Carbothioic s-ester - Sulfenyl compound - Thiocarboxylic acid or derivatives - Carboxylic acid derivative - Organopnictogen compound - Organic nitrogen compound - Amine - Primary amine - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic salt - Organic oxygen compound - Organic oxide - Organic chloride salt - Hydrocarbon derivative - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as aminobenzoic acids and derivatives. These are benzoic acids (or derivative thereof) containing an amine group attached to the benzene moiety.
External Descriptors
Not available