Compound Identification
SMILES
CCN(CCCC1CCN(CC(=O)N2C3=C(C=C(Cl)C=C3)C(=O)NC3=C2N=CC=C3)CC1)C(=O)C(C)(C)CC
InChIKey
InChIKey=MRKKRGMPXWQLFR-UHFFFAOYSA-N
Formula
C30H40ClN5O3
Mass
554.13
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Benzodiazepines
- Subclass 1,4-benzodiazepines
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Class
Benzodiazepines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzodiazepines
Subclass
1,4-benzodiazepines
Intermediate Tree Nodes
Not available
Direct Parent
1,4-benzodiazepines
Alternative Parents
Pyridodiazepines Alpha amino acids and derivatives 1,4-diazepines Aryl chlorides Benzenoids Imidolactams N-acyl amines Piperidines Pyridines and derivatives Vinylogous amides Heteroaromatic compounds Tertiary carboxylic acid amides Lactams Trialkylamines Secondary carboxylic acid amides Azacyclic compounds Hydrocarbon derivatives Organic oxides Organochlorides Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Pyrido-para-diazepine - 1,4-benzodiazepine - Alpha-amino acid or derivatives - Para-diazepine - Aryl chloride - Aryl halide - N-acyl-amine - Piperidine - Pyridine - Benzenoid - Imidolactam - Tertiary carboxylic acid amide - Heteroaromatic compound - Vinylogous amide - Tertiary amine - Secondary carboxylic acid amide - Amino acid or derivatives - Tertiary aliphatic amine - Carboxamide group - Lactam - Azacycle - Carboxylic acid derivative - Organic oxide - Amine - Organohalogen compound - Organochloride - Carbonyl group - Organonitrogen compound - Organic nitrogen compound - Organic oxygen compound - Organooxygen compound - Hydrocarbon derivative - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 1,4-benzodiazepines. These are organic compounds containing a benzene ring fused to a 1,4-azepine.
External Descriptors
Not available