Compound Identification
SMILES
OC(=O)P(O)(O)=O.C[C@H]1CN2C(=S)NC3=C2C(CN1CC=C(C)C)=C(Cl)C=C3
InChIKey
InChIKey=CNSBVOXJEIWJMP-MERQFXBCSA-N
Formula
C17H23ClN3O5PS
Mass
447.87
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
Benzimidazoles 1,4-diazepines Aralkylamines Aryl chlorides Benzenoids Imidazolethiones N-substituted imidazoles Heteroaromatic compounds Organic phosphonic acids Trialkylamines Thioureas Azacyclic compounds Hydrocarbon derivatives Organophosphorus compounds Organic oxides Organochlorides Organooxygen compounds
Molecular Framework
Not available
Substituents
1,4-benzodiazepine - Benzimidazole - Para-diazepine - Aralkylamine - Aryl chloride - Aryl halide - Imidazole-2-thione - N-substituted imidazole - Benzenoid - Azole - Imidazole - Heteroaromatic compound - Organophosphonic acid - Organophosphonic acid derivative - Tertiary amine - Thiourea - Tertiary aliphatic amine - Azacycle - Organooxygen compound - Organonitrogen compound - Organochloride - Organic oxide - Organic oxygen compound - Organohalogen compound - Amine - Hydrocarbon derivative - Organic nitrogen compound - Organophosphorus compound - Organosulfur compound - 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