Compound Identification
SMILES
CC(C)OC1=NC=C(C=C1C#N)C1=NC(=NO1)C1=CC2=C(CCN(CC2)C(CO)CO)C=C1
InChIKey
InChIKey=QZDZXOIWKHHBLA-UHFFFAOYSA-N
Formula
C24H27N5O4
Mass
449.511
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
3-pyridinecarbonitriles Azepines Aralkylamines Alkyl aryl ethers Benzenoids Heteroaromatic compounds 1,2,4-oxadiazoles Trialkylamines 1,2-aminoalcohols Oxacyclic compounds Nitriles Azacyclic compounds Primary alcohols Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzazepine - 3-pyridinecarbonitrile - Alkyl aryl ether - Azepine - Aralkylamine - Pyridine - Benzenoid - 1,2,4-oxadiazole - Azole - Oxadiazole - Heteroaromatic compound - Tertiary amine - Tertiary aliphatic amine - 1,2-aminoalcohol - Azacycle - Oxacycle - Ether - Nitrile - Carbonitrile - Hydrocarbon derivative - Organonitrogen compound - Cyanide - Organooxygen compound - Organic oxygen compound - Amine - Alcohol - Organic nitrogen compound - Primary alcohol - 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