Compound Identification
SMILES
CN1CC2=C(N=CN2C2=C(C=C(F)C=C2)C1=O)C(=O)OCCOS(=O)(=O)C1=CC=C(C)C=C1
InChIKey
InChIKey=NHSBGGBMZWWZJG-UHFFFAOYSA-N
Formula
C22H20FN3O6S
Mass
473.48
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
Imidazo[1,5-a][1,4]benzodiazepines
Alternative Parents
p-Methylbenzenesulfonates Benzenesulfonate esters Tosyl compounds Arylsulfonic acids and derivatives Benzenesulfonyl compounds 1,4-diazepines Carbonylimidazoles Aryl fluorides Organosulfonic acid esters N-substituted imidazoles Tertiary carboxylic acid amides Heteroaromatic compounds Vinylogous amides Sulfonyls Lactams Carboxylic acid esters Azacyclic compounds Hydrocarbon derivatives Organooxygen compounds Organic oxides Organofluorides Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Imidazo[1,5-a][1,4]benzodiazepine - Benzenesulfonate ester - P-methylbenzenesulfonate - Tosyl compound - Benzenesulfonate - Benzenesulfonyl group - Arylsulfonic acid or derivatives - Para-diazepine - Imidazole-4-carbonyl group - Toluene - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - N-substituted imidazole - Benzenoid - Organosulfonic acid ester - Azole - Heteroaromatic compound - Imidazole - Vinylogous amide - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Tertiary carboxylic acid amide - Sulfonyl - Lactam - Carboxylic acid ester - Carboxamide group - Carboxylic acid derivative - Azacycle - Organohalogen compound - Organic oxide - Organic oxygen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Hydrocarbon derivative - Organic nitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as imidazo[1,5-a][1,4]benzodiazepines. These are compounds containing an imidazole ring and a 1,4-benzodiazepine ring system, both sharing one nitrogen atom.
External Descriptors
Not available