Compound Identification
SMILES
OC1=C(C=CC(=C1)C#N)N=C1N2C(CCS2(=O)=O)C(=O)N1C1=CC=CC=C1Br
InChIKey
InChIKey=HIVUGAHLNCMMGH-UHFFFAOYSA-N
Formula
C18H13BrN4O4S
Mass
461.29
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Azolidines
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Subclass
Imidazolidines
- Level 5 Phenylimidazolidines
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Subclass
Imidazolidines
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Class
Azolidines
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Azolidines
Subclass
Imidazolidines
Intermediate Tree Nodes
Not available
Direct Parent
Phenylimidazolidines
Alternative Parents
Alpha amino acids and derivatives Benzonitriles 1-hydroxy-2-unsubstituted benzenoids 1-hydroxy-4-unsubstituted benzenoids Gamma sultams Bromobenzenes Aryl bromides Imidazolidinones Organosulfonic acids and derivatives Guanidines Propargyl-type 1,3-dipolar organic compounds Nitriles Azacyclic compounds Organobromides Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenylimidazolidine - Alpha-amino acid or derivatives - Benzonitrile - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Halobenzene - Phenol - Bromobenzene - Gamma-sultam - Imidazolidinone - Aryl bromide - Aryl halide - Benzenoid - Monocyclic benzene moiety - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Guanidine - Azacycle - Carboxylic acid derivative - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Carbonitrile - Nitrile - Cyanide - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Organic oxide - Hydrocarbon derivative - Organohalogen compound - Organobromide - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as phenylimidazolidines. These are polycyclic compounds containing an imidazoline substituted by a phenyl group.
External Descriptors
Not available