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Chemical Entities of Biological Interest Ontology
Last uploaded:
May 1, 2026
| Id | http://purl.obolibrary.org/obo/CHEBI_177728
http://purl.obolibrary.org/obo/CHEBI_177728
|
|---|---|
| Preferred Name | sufotidine |
| Synonyms |
2-methyl-5-(methylsulonylmethyl)-N-[3-[3-(piperidin-1-ylmethyl)phenoxy]propyl]-1,2,4-triazol-3-amine
|
| Type | http://www.w3.org/2002/07/owl#Class |
All Properties
| prefLabel | sufotidine
|
|---|---|
| label | sufotidine
|
| has_exact_synonym | 2-methyl-5-(methylsulonylmethyl)-N-[3-[3-(piperidin-1-ylmethyl)phenoxy]propyl]-1,2,4-triazol-3-amine
|
| has_obo_namespace | chebi_ontology
|
| type | |
| has_related_synonym | 2-methyl-5-(methylsulonylmethyl)-N-[3-[3-(piperidin-1-ylmethyl)phenoxy]propyl]-1,2,4-triazol-3-amine
|
| id | CHEBI:177728
|
| _generalized_empirical_formula | C20H31N5O3S
|
| in_subset | |
| _monoisotopic_mass | 421.21476
|
| notation | CHEBI:177728
|
| _inchi_string | InChI=1S/C20H31N5O3S/c1-24-20(22-19(23-24)16-29(2,26)27)21-10-7-13-28-18-9-6-8-17(14-18)15-25-11-4-3-5-12-25/h6,8-9,14H,3-5,7,10-13,15-16H2,1-2H3,(H,21,22,23)
|
| chemrof_charge | 0
|
| _inchi_key_string | JEYKZWRXDALMNG-UHFFFAOYSA-N
|
| database_cross_reference |
cas:80343-63-1
kegg.drug:D05939
chemspider:64802
|
| chemrof_mass | 421.567
|
| _smiles_string | Cn1nc(CS(C)(=O)=O)nc1NCCCOc1cccc(CN2CCCCC2)c1
|
| treeView | |
| subClassOf |
| Delete | Subject | Author | Type | Created |
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