Compound Identification
SMILES
CC1=C2[C@@H](SCC(=O)N=C2N(N1)[C@H]1CCOC(C)(C)C1)C1=CC=C(Br)C=C1
InChIKey
InChIKey=HOWOFPYSDGHJNA-YJBOKZPZSA-N
Formula
C20H24BrN3O2S
Mass
450.4
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
-
Subclass
Halobenzenes
- Level 5 Bromobenzenes
-
Subclass
Halobenzenes
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Halobenzenes
Intermediate Tree Nodes
Not available
Direct Parent
Bromobenzenes
Alternative Parents
Oxanes Aryl bromides Pyrazolines N-acylimines Amidrazones Propargyl-type 1,3-dipolar organic compounds Oxacyclic compounds Dialkylthioethers Dialkyl ethers Azacyclic compounds Organopnictogen compounds Organobromides Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Bromobenzene - Aryl bromide - Aryl halide - Oxane - Pyrazoline - Carboxylic acid amidrazone - N-acylimine - Carboxylic acid derivative - Dialkyl ether - Ether - Oxacycle - Thioether - Azacycle - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Dialkylthioether - Organoheterocyclic compound - Organobromide - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organopnictogen compound - Organic oxide - Carbonyl group - Organic nitrogen compound - Organic oxygen compound - Organohalogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as bromobenzenes. These are organic compounds containing a bromine atom attached to a benzene ring.
External Descriptors
Not available