Compound Identification
SMILES
ClC1=C(NC2=N[C@H]3CS(=O)(=O)C[C@@H]3S2)C=C(C=C1)C(=O)N1CCN(CC1)C1=CC=CC=[NH+]1
InChIKey
InChIKey=APGYWENGIMQFNZ-ROUUACIJSA-O
Formula
C21H23ClN5O3S2
Mass
493.02
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 Pyridinylpiperazines
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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
Pyridinylpiperazines
Alternative Parents
N-arylpiperazines 4-halobenzoic acids and derivatives Aminobenzoic acids and derivatives Benzamides Benzoyl derivatives Dialkylarylamines Thienothiazoles Aniline and substituted anilines Aminopyridines and derivatives Chlorobenzenes Aryl chlorides Pyridinium derivatives Thiazolines Thiolanes Heteroaromatic compounds Thiophenes Sulfones Tertiary carboxylic acid amides Thiazoles Isothioureas Azacyclic compounds Organooxygen compounds Hydrocarbon derivatives Organic oxides Organochlorides Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Pyridinylpiperazine - N-arylpiperazine - Aminobenzoic acid or derivatives - Halobenzoic acid or derivatives - 4-halobenzoic acid or derivatives - Benzamide - Benzoic acid or derivatives - Benzoyl - Aniline or substituted anilines - Dialkylarylamine - Thienothiazole - Aminopyridine - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Pyridine - Pyridinium - Thiolane - Thiophene - Meta-thiazoline - Thiazole - Tertiary carboxylic acid amide - Sulfone - Heteroaromatic compound - Isothiourea - Carboxamide group - Azacycle - Carboxylic acid derivative - Amine - Organohalogen compound - Organic oxide - Hydrocarbon derivative - Organochloride - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Organic oxygen compound - Organic cation - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as pyridinylpiperazines. These are compounds containing a pyridinylpiperazine skeleton, which consists of a pyridine linked (not fused) to a piperazine by a bond by a single bond that is not part of a ring.
External Descriptors
Not available