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CHEBI ONTOLOGY - ANNOTATIONS

The Chemical Entities of Biological Interest (ChEBI) ontology is downloaded weekly from EMBL-EBI at http://www.ebi.ac.uk/chebi/. The data is made available under the Creative Commons License (CC BY 3.0, http://creativecommons.org/licenses/by/3.0/). For more information see: Degtyarenko et al. (2008) ChEBI: a database and ontology for chemical entities of biological interest. Nucleic Acids Res. 36, D344–D350.

Term:N-\{2-[(4-benzylpiperidin-1-yl)methyl]benzimidazol-5-yl\}methanesulfonamide
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Accession:CHEBI:177875 term browser browse the term
Definition:A member of the class of benzimidazoles that is 1H-benzimidazole substituted by (4-benzylpiperidin-1-yl)methyl and (methylsulfonyl)amino groups at positions 2 and 6, respectively. It is a potent antagonist of the GluN2B subunit of the N-methyl-D-aspartate (NMDA) receptor.
Synonyms:exact_synonym: N-{2-[(4-benzylpiperidin-1-yl)methyl]-1H-benzimidazol-6-yl}methanesulfonamide
 related_synonym: Formula=C21H26N4O2S;   InChI=1S/C21H26N4O2S/c1-28(26,27)24-18-7-8-19-20(14-18)23-21(22-19)15-25-11-9-17(10-12-25)13-16-5-3-2-4-6-16/h2-8,14,17,24H,9-13,15H2,1H3,(H,22,23);   InChIKey=WAUCNDQNILDAKL-UHFFFAOYSA-N;   N-[2-(4-Benzyl-piperidin-1-ylmethyl)-3H-benzoimidazol-5-yl]-methanesulfonamide;   N-{2-[(4-benzylpiperidin-1-yl)methyl]benzimidazol-5-yl}methanesulphonamide;   N-{2-[(4-benzylpiperidin-1-yl)methyl]benzimidazol-5-yl}propane-2-sulfonamide;   SMILES=CS(=O)(=O)NC1=CC2=C(C=C1)N=C(CN1CCC(CC3=CC=CC=C3)CC1)N2;   XK1
 xref: Chemspider:7997968;   PMID:15056006;   PMID:16782335;   PMID:17290978;   PMID:20082612;   PMID:21453995



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  CHEBI ontology 19800
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        refrigerant 17688
          ammonia 17277
            organic amino compound 17277
              tertiary amino compound 8697
                N-\{2-[(4-benzylpiperidin-1-yl)methyl]benzimidazol-5-yl\}methanesulfonamide 0
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  CHEBI ontology 19800
    subatomic particle 19799
      composite particle 19799
        hadron 19799
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            nucleon 19799
              atomic nucleus 19799
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                          oxygen molecular entity 19423
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                                chalcogen oxoacid 11498
                                  sulfur oxoacid 11106
                                    sulfonic acid 7371
                                      sulfonic acid derivative 7371
                                        sulfonamide 3196
                                          N-\{2-[(4-benzylpiperidin-1-yl)methyl]benzimidazol-5-yl\}methanesulfonamide 0
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