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Biological and Environmental Research Ontology
Last uploaded:
December 23, 2022
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| Preferred Name | pimozide | |
| Synonyms |
Neoperidole Halomonth Opiran Orap pimozida pimozide pimozidum 1-{1-[4,4-bis(4-fluorophenyl)butyl]piperidin-4-yl}-1,3-dihydro-2H-benzimidazol-2-one Pimozide |
|
| Definitions |
A member of the class of benzimidazoles that is 1,3-dihydro-2H-benzimidazol-2-one in which one of the nitrogens is substituted by a piperidin-4-yl group, which in turn is substituted on the nitrogen by a 4,4-bis(p-fluorophenyl)butyl group. |
|
| ID |
http://purl.obolibrary.org/obo/CHEBI_8212 |
|
| alternative term |
Neoperidole Halomonth Opiran Orap pimozida pimozide pimozidum 1-{1-[4,4-bis(4-fluorophenyl)butyl]piperidin-4-yl}-1,3-dihydro-2H-benzimidazol-2-one Pimozide
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|
| bearer of |
http://purl.obolibrary.org/obo/CHEBI_37955 http://purl.obolibrary.org/obo/CHEBI_65190 http://purl.obolibrary.org/obo/CHEBI_66956 |
|
| charge |
0
|
|
| database_cross_reference |
CAS:2062-78-4 DrugBank:DB01100 KEGG:C07566 Beilstein:729089 KEGG:D00560 LINCS:LSM-2001 HMDB:HMDB0015232 Drug_Central:2172 Reaxys:729089 Wikipedia:Pimozide
|
|
| definition |
A member of the class of benzimidazoles that is 1,3-dihydro-2H-benzimidazol-2-one in which one of the nitrogens is substituted by a piperidin-4-yl group, which in turn is substituted on the nitrogen by a 4,4-bis(p-fluorophenyl)butyl group.
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|
| formula |
C28H29F2N3O
|
|
| has_exact_synonym |
1-{1-[4,4-bis(4-fluorophenyl)butyl]piperidin-4-yl}-1,3-dihydro-2H-benzimidazol-2-one Pimozide pimozide
|
|
| has_obo_namespace |
chebi_ontology
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|
| has_related_synonym |
Neoperidole Halomonth Opiran Orap pimozida pimozide pimozidum
|
|
| id |
CHEBI:8212
|
|
| in_subset | ||
| inchi |
InChI=1S/C28H29F2N3O/c29-22-11-7-20(8-12-22)25(21-9-13-23(30)14-10-21)4-3-17-32-18-15-24(16-19-32)33-27-6-2-1-5-26(27)31-28(33)34/h1-2,5-14,24-25H,3-4,15-19H2,(H,31,34)
|
|
| inchikey |
YVUQSNJEYSNKRX-UHFFFAOYSA-N
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|
| label |
pimozide
|
|
| mass |
461.54620
|
|
| monoisotopicmass |
461.22787
|
|
| notation |
CHEBI:8212
|
|
| prefLabel |
pimozide
|
|
| RO_0000087 |
http://purl.obolibrary.org/obo/CHEBI_37955 http://purl.obolibrary.org/obo/CHEBI_65190 http://purl.obolibrary.org/obo/CHEBI_66956 |
|
| smiles |
Fc1ccc(cc1)C(CCCN1CCC(CC1)n1c2ccccc2[nH]c1=O)c1ccc(F)cc1
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|
| subClassOf |
http://purl.obolibrary.org/obo/CHEBI_48585 |
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