Compound Identification
SMILES
O=C(N1CCOCC1)C1=CN2C(=CN=C2C2=CSC=C2)C2=CC=CC=C12
InChIKey
InChIKey=YNWIPTKAYVZUKH-UHFFFAOYSA-N
Formula
C20H17N3O2S
Mass
363.44
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Isoquinolines and derivatives
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Isoquinolines and derivatives
Alternative Parents
Pyridinecarboxylic acids and derivatives Morpholine carboxylic acids and derivatives N-substituted imidazoles Benzenoids Vinylogous amides Thiophenes Tertiary carboxylic acid amides Heteroaromatic compounds Oxacyclic compounds Dialkyl ethers Azacyclic compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Isoquinoline - Morpholine-4-carboxylic acid or derivatives - Pyridine carboxylic acid or derivatives - Morpholine - N-substituted imidazole - Oxazinane - Pyridine - Benzenoid - Azole - Imidazole - Heteroaromatic compound - Tertiary carboxylic acid amide - Thiophene - Vinylogous amide - Carboxamide group - Oxacycle - Azacycle - Carboxylic acid derivative - Dialkyl ether - Ether - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as isoquinolines and derivatives. These are aromatic polycyclic compounds containing an isoquinoline moiety, which consists of a benzene ring fused to a pyridine ring and forming benzo[c]pyridine.
External Descriptors
Not available