Compound Identification
SMILES
COC1=CC=CC(=C1)C1N(C(=O)CC2=CC=C(Cl)C=C2)C2=CC=CC=C2NC2=C1C(=O)CC(C)(C)C2
InChIKey
InChIKey=XEDUAZAMCOWNNS-UHFFFAOYSA-N
Formula
C30H29ClN2O3
Mass
501.02
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Benzodiazepines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzodiazepines
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Benzodiazepines
Alternative Parents
Phenylacetamides Phenoxy compounds Anisoles Methoxybenzenes 1,4-diazepines Alkyl aryl ethers Secondary alkylarylamines Chlorobenzenes Cyclohexenones Aryl chlorides Vinylogous amides Tertiary carboxylic acid amides Amino acids and derivatives Azacyclic compounds Enamines Hydrocarbon derivatives Organic oxides Organochlorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzodiazepine - Phenylacetamide - Phenoxy compound - Anisole - Methoxybenzene - Phenol ether - Para-diazepine - Alkyl aryl ether - Cyclohexenone - Chlorobenzene - Halobenzene - Secondary aliphatic/aromatic amine - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Tertiary carboxylic acid amide - Vinylogous amide - Amino acid or derivatives - Ketone - Carboxamide group - Secondary amine - Ether - Enamine - Azacycle - Carboxylic acid derivative - Organonitrogen compound - Carbonyl group - Hydrocarbon derivative - Amine - Organic oxygen compound - Organic nitrogen compound - Organic oxide - Organooxygen compound - Organohalogen compound - Organochloride - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as benzodiazepines. These are organic compounds containing a benzene ring fused to either isomers of diazepine(unsaturated seven-member heterocycle with two nitrogen atoms replacing two carbon atoms).
External Descriptors
Not available