Compound Identification
SMILES
CN1N=NN=C1SCC(O)[C@H](CC1CCCCC1)NC(=O)N[C@@H]1N=C(C2=CC=CC=C2)C2=CC=CC=C2N(C)C1=O
InChIKey
InChIKey=IMBBJVLVGZVJAX-NMUSUVFJSA-N
Formula
C29H36N8O3S
Mass
576.72
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Benzodiazepines
- Subclass 1,4-benzodiazepines
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Class
Benzodiazepines
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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
Alpha amino acids and derivatives Alkylarylthioethers Benzene and substituted derivatives Tetrazoles Tertiary carboxylic acid amides Heteroaromatic compounds Ureas Secondary alcohols Lactams Ketimines Sulfenyl compounds Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organic oxides Carbonyl compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1,4-benzodiazepine - Alpha-amino acid or derivatives - Aryl thioether - Alkylarylthioether - Monocyclic benzene moiety - Benzenoid - Azole - Tertiary carboxylic acid amide - Tetrazole - Heteroaromatic compound - Urea - Carboxamide group - Secondary alcohol - Ketimine - Lactam - Propargyl-type 1,3-dipolar organic compound - Azacycle - Sulfenyl compound - Thioether - Organic 1,3-dipolar compound - Carboxylic acid derivative - Organic oxide - Organonitrogen compound - Organooxygen compound - Imine - Organosulfur compound - Organic nitrogen compound - Carbonyl group - Organic oxygen compound - Hydrocarbon derivative - Alcohol - 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