Compound Identification
SMILES
Cl.CC1=CC2=C(C=C1)N=C(S2)C1=CC=C(N\N=C2/C(=O)C3=C(C=C(NC4=NC(=NC(=N4)N4CCN(CCN)CC4)N4CCN(CCN)CC4)C=C3)C=C2S(O)(=O)=O)C=C1
InChIKey
InChIKey=ZHSYNNXJGPKPEZ-RRWUGCIQSA-N
Formula
C39H46ClN13O4S2
Mass
860.45
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
Naphthalenes Benzothiazoles Phenylhydrazines Aryl ketones Dialkylarylamines N-alkylpiperazines Aminotriazines 1,3,5-triazines Thiazoles Sulfonyls Organosulfonic acids Heteroaromatic compounds Trialkylamines Azacyclic compounds Hydrazones Hydrocarbon derivatives Hydrochlorides Monoalkylamines Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
N-arylpiperazine - Naphthalene - 1,3-benzothiazole - Phenylhydrazine - Dialkylarylamine - Aryl ketone - Amino-1,3,5-triazine - Aminotriazine - N-alkylpiperazine - Monocyclic benzene moiety - 1,3,5-triazine - Triazine - Benzenoid - Azole - Heteroaromatic compound - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Organosulfonic acid - Sulfonyl - Thiazole - Tertiary aliphatic amine - Tertiary amine - Ketone - Azacycle - Hydrazone - Hydrochloride - Organonitrogen compound - Organic nitrogen compound - Primary aliphatic amine - Organooxygen compound - Organosulfur compound - Amine - Organic oxide - Primary amine - Hydrocarbon derivative - Organic oxygen compound - 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