Compound Identification
SMILES
CCCCSC1=NC2=C(N=N1)C1=CC=CC=C1NC(O2)C=CC1=CC=C(O1)[N+]([O-])=O
InChIKey
InChIKey=VNHLHHSLPGMIHM-UHFFFAOYSA-N
Formula
C20H19N5O4S
Mass
425.46
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Benzoxazepines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzoxazepines
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Benzoxazepines
Alternative Parents
Nitroaromatic compounds Nitrofurans 1,3-oxazepines Alkylarylthioethers 1,2,4-triazines Benzenoids Heteroaromatic compounds Sulfenyl compounds Propargyl-type 1,3-dipolar organic compounds Oxacyclic compounds Azacyclic compounds Organic oxoazanium compounds Organooxygen compounds Organic zwitterions Hydrocarbon derivatives Organic salts Amines Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzoxazepine - Aryl thioether - Nitroaromatic compound - 2-nitrofuran - Meta-oxazepine - Alkylarylthioether - Triazine - 1,2,4-triazine - Benzenoid - Furan - Heteroaromatic compound - C-nitro compound - Organic nitro compound - Oxacycle - Organic oxoazanium - Thioether - Azacycle - Sulfenyl compound - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Organic oxide - Organic zwitterion - Organic salt - Hydrocarbon derivative - Organic nitrogen compound - Amine - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as benzoxazepines. These are organic compounds containing a benzene fused to an oxazepine ring (a seven-membered ring with four carbon atoms, one oxygen atom, and a nitrogen atom).
External Descriptors
Not available