Compound Identification
SMILES
CC(C)C1=CC=CC=C1OC\C=N\NC1=NC(=CS1)C1=CC=C(Cl)C=C1
InChIKey
InChIKey=NXFDDDVVSRCFNO-SSDVNMTOSA-N
Formula
C20H20ClN3OS
Mass
385.91
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Cumenes
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Cumenes
Intermediate Tree Nodes
Not available
Direct Parent
Cumenes
Alternative Parents
Phenylpropanes Phenoxy compounds Phenol ethers Chlorobenzenes Alkyl aryl ethers 2,4-disubstituted thiazoles Aryl chlorides Heteroaromatic compounds Hydrazones Azacyclic compounds Organochlorides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenylpropane - Cumene - Phenoxy compound - Phenol ether - 2,4-disubstituted 1,3-thiazole - Alkyl aryl ether - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Heteroaromatic compound - Azole - Thiazole - Azacycle - Organoheterocyclic compound - Ether - Hydrazone - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Organic nitrogen compound - Organochloride - Hydrocarbon derivative - Organohalogen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as cumenes. These are aromatic compounds containing a prop-2-ylbenzene moiety.
External Descriptors
Not available