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The Drug-Drug Interactions Ontology
Last uploaded:
February 11, 2016
| Id | http://purl.obolibrary.org/obo/dinto_DB06957
http://purl.obolibrary.org/obo/dinto_DB06957
|
|---|---|
| Preferred Name | 4-chloro-6-(4-{4-[4-(methylsulfonyl)benzyl]piperazin-1-yl}-1h-pyrazol-5-yl)benzene-1,3-diol |
| Synonyms |
4-chloro-6-(4-{4-[(4-methanesulfonylphenyl)methyl]piperazin-1-yl}-1H-pyrazol-5-yl)benzene-1,3-diol
C21H23ClN4O4S
|
| Type | http://www.w3.org/2002/07/owl#Class |
All Properties
| prefLabel | 4-chloro-6-(4-{4-[4-(methylsulfonyl)benzyl]piperazin-1-yl}-1h-pyrazol-5-yl)benzene-1,3-diol
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|---|---|
| label | 4-chloro-6-(4-{4-[4-(methylsulfonyl)benzyl]piperazin-1-yl}-1h-pyrazol-5-yl)benzene-1,3-diol
|
| type | |
| InChIKey | InChIKey=BDFJIEMVNDLSTB-UHFFFAOYSA-N
|
| Synonym |
4-chloro-6-(4-{4-[(4-methanesulfonylphenyl)methyl]piperazin-1-yl}-1H-pyrazol-5-yl)benzene-1,3-diol
C21H23ClN4O4S
|
| xref |
ChemSpider:20136271
PDB:2D9
PubChem Compound:10095904
PubChem Substance:99443428
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| prefixIRI | obo2:dinto_DB06957
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| related with | |
| SMILES | CS(=O)(=O)C1=CC=C(CN2CCN(CC2)C2=C(NN=C2)C2=CC(Cl)=C(O)C=C2O)C=C1
|
| InChI | InChI=1S/C21H23ClN4O4S/c1-31(29,30)15-4-2-14(3-5-15)13-25-6-8-26(9-7-25)18-12-23-24-21(18)16-10-17(22)20(28)11-19(16)27/h2-5,10-12,27-28H,6-9,13H2,1H3,(H,23,24)
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| subClassOf |
| Delete | Subject | Author | Type | Created |
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| No notes to display |