Compound Identification
SMILES
CCCCCCCC(=O)NC(=S)NNC(=O)COC1=C(Br)C=C(C=C1)C(C)C
InChIKey
InChIKey=WUQUGISVBAWZKR-UHFFFAOYSA-N
Formula
C20H30BrN3O3S
Mass
472.44
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 Bromobenzenes Alkyl aryl ethers N-acyl amines Aryl bromides Thiosemicarbazides Carboxylic acid hydrazides Organosulfur compounds Organobromides Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Phenylpropane - Cumene - Phenoxy compound - Phenol ether - Alkyl aryl ether - Bromobenzene - Halobenzene - Aryl bromide - Aryl halide - N-acyl-amine - Thiosemicarbazide - Carboxylic acid hydrazide - Carboxylic acid derivative - Ether - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organobromide - Organohalogen compound - Aromatic homomonocyclic 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