Compound Identification
SMILES
O=C1NC(=O)\C(S1)=C/C1=CC=C(C=C1)C#CCN1C(=O)COC2=CC=CC=C12
InChIKey
InChIKey=LCCOHIAQMYQGRJ-LDADJPATSA-N
Formula
C21H14N2O4S
Mass
390.41
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Benzoxazines
- Subclass Benzoxazinones
-
Class
Benzoxazines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzoxazines
Subclass
Benzoxazinones
Intermediate Tree Nodes
Not available
Direct Parent
Benzoxazinones
Alternative Parents
Benzomorpholines Thiazolidinediones Alkyl aryl ethers Benzene and substituted derivatives Tertiary carboxylic acid amides Dicarboximides Thiocarbamic acid derivatives Lactams Oxacyclic compounds Azacyclic compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzoxazinone - Benzomorpholine - Alkyl aryl ether - Thiazolidinedione - Monocyclic benzene moiety - Oxazinane - Benzenoid - Dicarboximide - Tertiary carboxylic acid amide - Thiazolidine - Carboxamide group - Lactam - Thiocarbamic acid derivative - Ether - Oxacycle - Carboxylic acid derivative - Azacycle - Organonitrogen compound - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organic oxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as benzoxazinones. These are organic compounds containing a benzene fused to an oxazine ring (a six-member aliphatic ring with four carbon atoms, one oxygen atom, and one nitrogen atom) bearing a ketone group.
External Descriptors
Not available