Preferred Name |
mebendazole |
|
Synonyms |
(5-benzoyl-1H-benzimidazol-2-yl)-carbamic acid methyl ester MBDZ Vermox methyl (5-benzoyl-1H-benzimidazol-2-yl)carbamate Mebendazole |
|
Definitions |
A carbamate ester that is methyl 1H-benzimidazol-2-ylcarbamate substituted by a benzoyl group at position 5. |
|
ID |
http://purl.obolibrary.org/obo/CHEBI_6704 |
|
alternative label |
(5-benzoyl-1H-benzimidazol-2-yl)-carbamic acid methyl ester MBDZ Vermox methyl (5-benzoyl-1H-benzimidazol-2-yl)carbamate Mebendazole |
|
charge |
0 |
|
database_cross_reference |
Reaxys:759809 Beilstein:759809 CAS:31431-39-7 PMID:6126101 LINCS:LSM-3749 DrugBank:DB00643 Wikipedia:Mebendazole KEGG:D00368 Drug_Central:1641 |
|
definition |
A carbamate ester that is methyl 1H-benzimidazol-2-ylcarbamate substituted by a benzoyl group at position 5. |
|
formula |
C16H13N3O3 |
|
has parent hydride | ||
has role | ||
has_exact_synonym |
methyl (5-benzoyl-1H-benzimidazol-2-yl)carbamate Mebendazole |
|
has_obo_namespace |
chebi_ontology |
|
has_related_synonym |
(5-benzoyl-1H-benzimidazol-2-yl)-carbamic acid methyl ester MBDZ Vermox |
|
has_RxCUI |
6672 |
|
id |
CHEBI:6704 |
|
in_subset | ||
inchi |
InChI=1S/C16H13N3O3/c1-22-16(21)19-15-17-12-8-7-11(9-13(12)18-15)14(20)10-5-3-2-4-6-10/h2-9H,1H3,(H2,17,18,19,21) |
|
inchikey |
OPXLLQIJSORQAM-UHFFFAOYSA-N |
|
label |
mebendazole Mebendazole |
|
mass |
295.29284 |
|
monoisotopicmass |
295.09569 |
|
notation |
CHEBI:6704 |
|
prefLabel |
mebendazole |
|
smiles |
COC(=O)Nc1nc2cc(ccc2[nH]1)C(=O)c1ccccc1 |
|
subClassOf |
http://purl.obolibrary.org/obo/CHEBI_76224 |