Compound Identification
SMILES
COC1=C(C=C(C=C1)[N+]([O-])=O)C1NC2=CC=CC=C2C2=C(O1)N=C(SC)N=N2
InChIKey
InChIKey=QJMYEDFKBMGELE-UHFFFAOYSA-N
Formula
C18H15N5O4S
Mass
397.41
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
Nitrophenyl ethers Methoxyanilines Anisoles Methoxybenzenes Nitroaromatic compounds Phenoxy compounds Alkyl aryl ethers 1,3-oxazepines Alkylarylthioethers 1,2,4-triazines Heteroaromatic compounds Organic oxoazanium compounds Propargyl-type 1,3-dipolar organic compounds Sulfenyl compounds Azacyclic compounds Oxacyclic compounds Organic oxides Hydrocarbon derivatives Amines Organic salts Organic zwitterions
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzoxazepine - Nitrophenyl ether - Nitrobenzene - Methoxyaniline - Nitroaromatic compound - Anisole - Methoxybenzene - Phenol ether - Aryl thioether - Phenoxy compound - Alkyl aryl ether - Meta-oxazepine - Alkylarylthioether - Monocyclic benzene moiety - 1,2,4-triazine - Triazine - Benzenoid - Heteroaromatic compound - C-nitro compound - Organic nitro compound - Oxacycle - Ether - Azacycle - Organic oxoazanium - Organic 1,3-dipolar compound - Thioether - Propargyl-type 1,3-dipolar organic compound - Sulfenyl compound - Allyl-type 1,3-dipolar organic compound - Organic oxide - Organic salt - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Hydrocarbon derivative - Organic nitrogen compound - Organic oxygen compound - Organic zwitterion - 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