Compound Identification
SMILES
CCOC(=O)N1CCC2=C(C1)SC1=C2C(=O)N[C@@H](N1)C1=CC=C(O1)C1=C(Cl)C(Cl)=CC=C1
InChIKey
InChIKey=VTEGKNJLWMREJP-IBGZPJMESA-N
Formula
C22H19Cl2N3O4S
Mass
492.37
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Thiophenes
-
Subclass
Aminothiophenes
- Level 5 2-aminothiophenes
-
Subclass
Aminothiophenes
-
Class
Thiophenes
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Thiophenes
Subclass
Aminothiophenes
Intermediate Tree Nodes
2-aminothiophenes
Direct Parent
3,4,5-trisubstituted-2-aminothiophenes
Alternative Parents
Dichlorobenzenes Secondary alkylarylamines Aryl chlorides Heteroaromatic compounds Furans Vinylogous amides Carbamate esters Secondary carboxylic acid amides Lactams Tertiary amines Oxacyclic compounds Azacyclic compounds Organochlorides Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
3,4,5-trisubstituted-2-aminothiophene - 1,2-dichlorobenzene - Halobenzene - Secondary aliphatic/aromatic amine - Chlorobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Furan - Heteroaromatic compound - Carbamic acid ester - Vinylogous amide - Carboxamide group - Secondary carboxylic acid amide - Tertiary amine - Lactam - Amino acid or derivatives - Oxacycle - Carboxylic acid derivative - Azacycle - Secondary amine - Organic oxygen compound - Organic nitrogen compound - Amine - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 3,4,5-trisubstituted-2-aminothiophenes. These are organic compounds containing a thiophene ring substituted at the 2-,3-,4-, and 5-position, with an amine group at the 2-position.
External Descriptors
Not available