Compound Identification
SMILES
O=C(NCCC1=CC=CC=C1)NC1=CC2=C(C=C(S2)C(=O)N[C@H]2CN3CCC2CC3)C=C1
InChIKey
InChIKey=MORUDEMULGREIK-NRFANRHFSA-N
Formula
C25H28N4O2S
Mass
448.59
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Benzothiophenes
- Subclass 1-benzothiophenes
-
Class
Benzothiophenes
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzothiophenes
Subclass
1-benzothiophenes
Intermediate Tree Nodes
Not available
Direct Parent
1-benzothiophenes
Alternative Parents
Thiophene carboxamides Quinuclidines 2-heteroaryl carboxamides 2,3,5-trisubstituted thiophenes Piperidines Benzene and substituted derivatives Heteroaromatic compounds Ureas Trialkylamines Secondary carboxylic acid amides Amino acids and derivatives Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1-benzothiophene - 2-heteroaryl carboxamide - Quinuclidine - Thiophene carboxamide - Thiophene carboxylic acid or derivatives - 2,3,5-trisubstituted thiophene - Monocyclic benzene moiety - Piperidine - Benzenoid - Heteroaromatic compound - Thiophene - Tertiary aliphatic amine - Amino acid or derivatives - Urea - Tertiary amine - Secondary carboxylic acid amide - Carboxamide group - Azacycle - Carboxylic acid derivative - Amine - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Organic oxide - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 1-benzothiophenes. These are aromatic heterocyclic compound containing the Benzo[b]thiophene ring system.
External Descriptors
Not available