Compound Identification
SMILES
CCC(=O)NCC1=C(Cl)C=C(C=C1)C(=O)N1CC2=CNN(C)C2=NC2=C1C=CC(Cl)=C2.CN1NC=C2CN(C(=O)C3=CC(Cl)=C(CNC(=O)C(C)(C)C)C=C3)C3=C(C=C(Cl)C=C3)N=C12
InChIKey
InChIKey=UYAXIYHLXWIHRI-UHFFFAOYSA-N
Formula
C46H46Cl4N10O4
Mass
944.74
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
3-halobenzoic acids and derivatives Benzamides Benzoyl derivatives 1,4-diazepines Chlorobenzenes Aryl chlorides Imidolactams Pyrazolines Tertiary carboxylic acid amides Amidrazones Secondary carboxylic acid amides Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Amidines Hydrocarbon derivatives Organochlorides Carbonyl compounds Organic oxides
Molecular Framework
Not available
Substituents
Benzodiazepine - 3-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Benzamide - Benzoic acid or derivatives - Benzoyl - Para-diazepine - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Imidolactam - Benzenoid - Tertiary carboxylic acid amide - Pyrazoline - Secondary carboxylic acid amide - Carboxylic acid amidrazone - Carboxamide group - Propargyl-type 1,3-dipolar organic compound - Amidine - Azacycle - Organic 1,3-dipolar compound - Carboxylic acid derivative - Hydrocarbon derivative - Organic oxide - Organohalogen compound - Organic oxygen compound - Organic nitrogen compound - Organooxygen compound - Carbonyl group - Organonitrogen 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