Compound Identification
SMILES
CCOC(=O)C1=C(NC(=O)CC2SC(N)=NC2=O)SC(Br)=C1CNC1CCCC1
InChIKey
InChIKey=RMMKEDFFUAHMMA-UHFFFAOYSA-N
Formula
C18H23BrN4O4S2
Mass
503.43
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Thiophenes
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Thiophenes
Subclass
Thiophene carboxylic acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Thiophene carboxylic acids and derivatives
Alternative Parents
N-arylamides Aralkylamines Aryl bromides Vinylogous amides Thiazolines Heteroaromatic compounds Secondary carboxylic acid amides Amino acids and derivatives N-acylimines Isothioureas Carboxylic acid esters Propargyl-type 1,3-dipolar organic compounds Dialkylamines Carboximidamides Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organobromides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Thiophene carboxylic acid or derivatives - N-arylamide - Aralkylamine - Aryl bromide - Aryl halide - Meta-thiazoline - Heteroaromatic compound - Vinylogous amide - Amino acid or derivatives - Carboxamide group - Carboxylic acid ester - Isothiourea - Secondary carboxylic acid amide - N-acylimine - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Secondary amine - Azacycle - Carboximidamide - Carboxylic acid derivative - Secondary aliphatic amine - Organic oxide - Organic nitrogen compound - Organohalogen compound - Organobromide - Amine - Hydrocarbon derivative - Carbonyl group - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as thiophene carboxylic acids and derivatives. These are compounds containing a thiophene ring which bears a carboxylic acid group (or a salt/ester thereof).
External Descriptors
Not available