Compound Identification
SMILES
OC(=O)C1=CC(=CC=C1)N1C(=S)NC(=O)C(=CC2=CN(CC3=CC(=CC=C3)[N+]([O-])=O)C3=CC=CC=C23)C1=O
InChIKey
InChIKey=WZXWSOUWQXKIAO-UHFFFAOYSA-N
Formula
C27H18N4O6S
Mass
526.52
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
Not available
Direct Parent
Acylaminobenzoic acid and derivatives
Alternative Parents
N-alkylindoles N-phenylthioureas Benzoic acids Thiobarbituric acid derivatives Indoles Nitrobenzenes Benzoyl derivatives Nitroaromatic compounds Substituted pyrroles Diazinanes Heteroaromatic compounds Thioureas Propargyl-type 1,3-dipolar organic compounds Carboxylic acids Azacyclic compounds Organic oxoazanium compounds Organic salts Organic zwitterions Organonitrogen compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Acylaminobenzoic acid or derivatives - N-phenylthiourea - N-alkylindole - Benzoic acid - Indole - Indole or derivatives - Nitrobenzene - Thiobarbiturate - Benzoyl - Nitroaromatic compound - 1,3-diazinane - Substituted pyrrole - Pyrrole - Heteroaromatic compound - C-nitro compound - Organic nitro compound - Thiourea - Carboxylic acid derivative - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Carboxylic acid - Organic 1,3-dipolar compound - Organoheterocyclic compound - Organic oxoazanium - Azacycle - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic zwitterion - Hydrocarbon derivative - Organic salt - Organic oxide - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as acylaminobenzoic acid and derivatives. These are derivatives of amino benzoic acid derivatives where the amine group is N-acylated.
External Descriptors
Not available