Compound Identification
SMILES
[Ac].O=C(CCC1CC[N-]CC1)C1=CC2=C(CCN(CC3=CC=CS3)CC2)C=C1
InChIKey
InChIKey=QYSRPTYQWXVBGI-UHFFFAOYSA-N
Formula
C23H29AcN2OS
Mass
608.56
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Benzazepines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzazepines
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Benzazepines
Alternative Parents
Butyrophenones Aryl alkyl ketones Azepines Aralkylamines Piperidines Thiophenes Heteroaromatic compounds Trialkylamines Azacyclic compounds Organic oxides Hydrocarbon derivatives Organic anions
Molecular Framework
Not available
Substituents
Benzazepine - Butyrophenone - Aryl alkyl ketone - Aryl ketone - Azepine - Aralkylamine - Piperidine - Benzenoid - Heteroaromatic compound - Thiophene - Ketone - Tertiary amine - Tertiary aliphatic amine - Azacycle - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Amine - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organic anion - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as benzazepines. These are organic compounds containing a benzene ring fused to an azepine ring (unsaturated seven-membered heterocycle with one nitrogen atom replacing a carbon atom).
External Descriptors
Not available