Compound Identification
SMILES
S=C=NC1=CC=CC(C[N+]2=CC=C(C=C2)C2=CN=C(O2)C2=CC3=C(OCCC3)C=C2)=C1
InChIKey
InChIKey=ABLGIPNTTBXOCN-UHFFFAOYSA-N
Formula
C25H20N3O2S
Mass
426.51
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Benzopyrans
- Subclass 1-benzopyrans
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Class
Benzopyrans
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzopyrans
Subclass
1-benzopyrans
Intermediate Tree Nodes
Not available
Direct Parent
1-benzopyrans
Alternative Parents
Alkyl aryl ethers 2,5-disubstituted oxazoles Pyridinium derivatives Benzene and substituted derivatives Heteroaromatic compounds Isothiocyanates Oxacyclic compounds Azacyclic compounds Organonitrogen compounds Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1-benzopyran - 2,5-disubstituted 1,3-oxazole - Alkyl aryl ether - Monocyclic benzene moiety - Benzenoid - Pyridinium - Pyridine - Azole - Heteroaromatic compound - Oxazole - Isothiocyanate - Oxacycle - Ether - Azacycle - Organonitrogen compound - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organooxygen compound - Organosulfur compound - Organic cation - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 1-benzopyrans. These are organic aromatic compounds that 1-benzopyran, a bicyclic compound made up of a benzene ring fused to a pyran, so that the oxygen atom is at the 1-position.
External Descriptors
Not available