Compound Identification
SMILES
O=C1NC(=O)C(=C1C1=CN2CCNCC3=CC=CC1=C23)C1=C2C=CSC2=CC=C1
InChIKey
InChIKey=XBNWVHKGHBNRAG-UHFFFAOYSA-N
Formula
C23H17N3O2S
Mass
399.47
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
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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
1-benzothiophenes Indoles Aralkylamines Maleimides Substituted pyrroles Benzenoids Thiophenes Pyrrolines Dicarboximides Heteroaromatic compounds N-unsubstituted carboxylic acid imides Amino acids and derivatives Dialkylamines Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1,4-benzodiazepine - Benzothiophene - Indole - Indole or derivatives - 1-benzothiophene - Maleimide - Aralkylamine - Substituted pyrrole - Benzenoid - Carboxylic acid imide - Dicarboximide - Carboxylic acid imide, n-unsubstituted - Pyrrole - Pyrroline - Thiophene - Heteroaromatic compound - Amino acid or derivatives - Secondary aliphatic amine - Secondary amine - Carboxylic acid derivative - Azacycle - Organooxygen compound - Organonitrogen compound - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Amine - 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