Compound Identification
SMILES
O=C1NC2=C(C=C(OC3CCN(CC4=CC=C(C=C4)C#N)CC3)C=C2)C2=C1CSCC2
InChIKey
InChIKey=MDJDYQHIETUAIQ-UHFFFAOYSA-N
Formula
C25H25N3O2S
Mass
431.55
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Quinolines and derivatives
-
Subclass
Quinolones and derivatives
- Level 5 Thiopyranoquinolines
-
Subclass
Quinolones and derivatives
-
Class
Quinolines and derivatives
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Quinolines and derivatives
Subclass
Quinolones and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Thiopyranoquinolines
Alternative Parents
Pyranoquinolines N-benzylpiperidines Hydroquinolones Hydroquinolines Phenylmethylamines Phenol ethers Benzonitriles Benzylamines Alkyl aryl ethers Pyridinones Aralkylamines Pyrans Heteroaromatic compounds Trialkylamines Lactams Nitriles Azacyclic compounds Dialkylthioethers Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Pyranoquinoline - Thiopyranoquinoline - N-benzylpiperidine - Benzylpiperidine - Dihydroquinolone - Dihydroquinoline - Benzonitrile - Benzylamine - Phenol ether - Phenylmethylamine - Alkyl aryl ether - Aralkylamine - Pyridinone - Monocyclic benzene moiety - Piperidine - Benzenoid - Pyran - Pyridine - Heteroaromatic compound - Tertiary amine - Tertiary aliphatic amine - Lactam - Thioether - Dialkylthioether - Azacycle - Ether - Nitrile - Carbonitrile - Amine - Hydrocarbon derivative - Organic oxide - Organonitrogen compound - Cyanide - Organic nitrogen compound - Organic oxygen compound - Organooxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as thiopyranoquinolines. These are polycyclic compounds containing a thiopyran ring fused to a quinoline moiety. Quinoline or benzo[b]pyridine is a bicyclic compound that consists of benzene fused to a pyridine.
External Descriptors
Not available