Compound Identification
SMILES
CSC1=CC=C(C=C1)C1OC2=C(C=C(Br)C=C2)C2CC(=NN12)C1=CC=CS1
InChIKey
InChIKey=GZDUMZKBMZQIHH-UHFFFAOYSA-N
Formula
C21H17BrN2OS2
Mass
457.4
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Benzoxazines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzoxazines
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Benzoxazines
Alternative Parents
Thiophenol ethers Alkylarylthioethers Benzene and substituted derivatives Aryl bromides Thiophenes Pyrazolines Heteroaromatic compounds Sulfenyl compounds Oxacyclic compounds Hydrazones Azacyclic compounds Organopnictogen compounds Organooxygen compounds Organobromides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzoxazine - Aryl thioether - Thiophenol ether - Alkylarylthioether - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Benzenoid - Heteroaromatic compound - Pyrazoline - Thiophene - Hydrazone - Oxacycle - Thioether - Azacycle - Sulfenyl compound - Organooxygen compound - Organonitrogen compound - Organobromide - Organohalogen compound - Organosulfur compound - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Hydrocarbon derivative - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as benzoxazines. These are organic compounds containing a benzene fused to an oxazine ring (a six-membered aliphatic ring with four carbon atoms, one oxygen atom, and one nitrogen atom).
External Descriptors
Not available