Compound Identification
SMILES
CCCCCSC1=NC2=C(N=N1)C1=CC=CC=C1NC(O2)C1=CC=C(O1)C1=C(C)C=C(C=C1)[N+]([O-])=O
InChIKey
InChIKey=LAXHIHZYLSOMFM-UHFFFAOYSA-N
Formula
C26H25N5O4S
Mass
503.58
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
Nitrobenzenes Nitrotoluenes Nitroaromatic compounds Secondary alkylarylamines 1,3-oxazepines Alkylarylthioethers 1,2,4-triazines Furans Heteroaromatic compounds Propargyl-type 1,3-dipolar organic compounds Sulfenyl compounds Azacyclic compounds Oxacyclic compounds Organic oxoazanium compounds Organic salts Organic zwitterions Organooxygen compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzoxazepine - Nitrotoluene - Nitrobenzene - Aryl thioether - Nitroaromatic compound - Meta-oxazepine - Secondary aliphatic/aromatic amine - Toluene - Alkylarylthioether - Monocyclic benzene moiety - Triazine - 1,2,4-triazine - Benzenoid - Furan - Heteroaromatic compound - Organic nitro compound - C-nitro compound - Organic 1,3-dipolar compound - Oxacycle - Sulfenyl compound - Organic oxoazanium - Azacycle - Thioether - Secondary amine - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Organosulfur compound - Organic zwitterion - Organic salt - Hydrocarbon derivative - Organic oxide - Organic oxygen 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