Compound Identification
SMILES
Cl.COC1=C(C(=O)NCCCCN2CCN(CC2)C2=NSC3=CC=CC=C23)C(O)=C(Br)C=C1
InChIKey
InChIKey=AYWPGXGIELSSTJ-UHFFFAOYSA-N
Formula
C23H28BrClN4O3S
Mass
555.92
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Diazinanes
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Subclass
Piperazines
- Level 5 N-arylpiperazines
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Subclass
Piperazines
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Class
Diazinanes
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Diazinanes
Subclass
Piperazines
Intermediate Tree Nodes
Not available
Direct Parent
N-arylpiperazines
Alternative Parents
Salicylamides 3-halobenzoic acids and derivatives Methoxyphenols Benzamides Benzothiazoles Anisoles Phenoxy compounds Benzoyl derivatives O-bromophenols Dialkylarylamines Methoxybenzenes 1-hydroxy-4-unsubstituted benzenoids Bromobenzenes N-alkylpiperazines Alkyl aryl ethers Aryl bromides Aminothiazoles Imidolactams Vinylogous acids Heteroaromatic compounds Secondary carboxylic acid amides Trialkylamines Amino acids and derivatives Azacyclic compounds Hydrocarbon derivatives Hydrochlorides Organic oxides Organobromides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
N-arylpiperazine - Methoxyphenol - Salicylamide - Salicylic acid or derivatives - 3-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Benzamide - Benzoic acid or derivatives - 1,2-benzothiazole - Anisole - Phenoxy compound - Benzoyl - 2-halophenol - 2-bromophenol - Phenol ether - Methoxybenzene - Dialkylarylamine - Bromobenzene - 1-hydroxy-4-unsubstituted benzenoid - Halobenzene - Alkyl aryl ether - N-alkylpiperazine - Phenol - 1,2-thiazolamine - Monocyclic benzene moiety - Aryl bromide - Benzenoid - Imidolactam - Aryl halide - Azole - Thiazole - Heteroaromatic compound - Vinylogous acid - Tertiary amine - Carboxamide group - Secondary carboxylic acid amide - Amino acid or derivatives - Tertiary aliphatic amine - Azacycle - Ether - Carboxylic acid derivative - Organic oxygen compound - Organic nitrogen compound - Organohalogen compound - Hydrochloride - Organobromide - Organonitrogen compound - Organooxygen compound - Amine - Hydrocarbon derivative - Organic oxide - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as n-arylpiperazines. These are organic compounds containing a piperazine ring where the nitrogen ring atom carries an aryl group.
External Descriptors
Not available