Compound Identification
SMILES
COC(=O)C1=CC=CC=C1NC=C(C#N)C1=NC(=CS1)C1=CC2=C(OC1=O)C=CC1=CC=CC=C21
InChIKey
InChIKey=BLKACYKEWKUVFY-UHFFFAOYSA-N
Formula
C27H17N3O4S
Mass
479.51
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Naphthopyrans
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Naphthopyrans
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Naphthopyrans
Alternative Parents
Coumarins and derivatives 1-benzopyrans Aminobenzoic acids and derivatives Benzoic acid esters Naphthalenes Aniline and substituted anilines Benzoyl derivatives Pyranones and derivatives 2,4-disubstituted thiazoles Vinylogous amides Methyl esters Heteroaromatic compounds Amino acids and derivatives Lactones Enamines Monocarboxylic acids and derivatives Nitriles Azacyclic compounds Secondary amines Oxacyclic compounds Organic oxides Organooxygen compounds Organopnictogen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Naphthopyran - Coumarin - Aminobenzoic acid or derivatives - Benzoate ester - Benzopyran - Naphthalene - 1-benzopyran - Benzoic acid or derivatives - Benzoyl - Aniline or substituted anilines - 2,4-disubstituted 1,3-thiazole - Pyranone - Monocyclic benzene moiety - Benzenoid - Pyran - Azole - Heteroaromatic compound - Vinylogous amide - Methyl ester - Thiazole - Amino acid or derivatives - Lactone - Carboxylic acid ester - Nitrile - Carbonitrile - Azacycle - Monocarboxylic acid or derivatives - Enamine - Oxacycle - Carboxylic acid derivative - Secondary amine - Amine - Hydrocarbon derivative - Organic oxide - Cyanide - Organopnictogen compound - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as naphthopyrans. These are compounds containing a pyran ring fused to a naphthalene moiety. Furan is a 6 membered-ring non-aromatic ring with five carbon and one oxygen atoms. Naphthalene is a polycyclic aromatic hydrocarbon made up of two fused benzene rings.
External Descriptors
Not available