Compound Identification
SMILES
CC1(C)OC2=C(C=C(C=C2)C#N)[C@H](N2C=CC=CC2=S)[C@]1(C)O
InChIKey
InChIKey=UQSAPFMRQFSJDY-WMZOPIPTSA-N
Formula
C18H18N2O2S
Mass
326.41
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Benzopyrans
-
Subclass
1-benzopyrans
- Level 5 2,2-dimethyl-1-benzopyrans
-
Subclass
1-benzopyrans
-
Class
Benzopyrans
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzopyrans
Subclass
1-benzopyrans
Intermediate Tree Nodes
Not available
Direct Parent
2,2-dimethyl-1-benzopyrans
Alternative Parents
Dihydropyridines Alkyl aryl ethers Benzenoids Thiolactams Tertiary alcohols Heteroaromatic compounds Oxacyclic compounds Nitriles Azacyclic compounds Organosulfur compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2,2-dimethyl-1-benzopyran - Alkyl aryl ether - Dihydropyridine - Hydropyridine - Pyridine - Benzenoid - Heteroaromatic compound - Tertiary alcohol - Thiolactam - Azacycle - Oxacycle - Ether - Carbonitrile - Nitrile - Organonitrogen compound - Hydrocarbon derivative - Organic oxygen compound - Alcohol - Organooxygen compound - Organosulfur compound - Organic nitrogen compound - Cyanide - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 2,2-dimethyl-1-benzopyrans. These are organic compounds containing a 1-benzopyran moiety that carries two methyl groups at the 2-position.
External Descriptors
Not available