Fenbendazole

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Systematic / IUPAC Name: Methyl [6-(phenylsulfanyl)-1H-benzimidazol-2-yl]carbamate

ID: Reference1613

Other Names: 2-(Methoxycarbonylamino)-5-(phenylthio)benzimidazole;
Methyl [5-(phenylsulfanyl)-1H-benzimidazol-2-yl]carbamate;
2-Benzimidazolecarbamic acid, 5-(phenylthio)-, methyl ester;
[5-(Phenylthio)-1H-benzimidazol-2-yl]carbamic acid methyl ester;
Methyl [5-(phenylthio)-1H-benzimidazol-2-yl]carbamate ; more

Formula: C15H13N3O2S

Class: Pesticides/Herbicides

Spectral Data

Fenbendazole mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Q Exactive Orbitrap
No. of Spectral Trees 3
No. of Spectra 279
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 12/2/2014 12:31:21 PM
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Identificators

InChI InChI=1S/C15H13N3O2S/c1-20-15(19)18-14-16-12-8-7-11(9-13(12)17-14)21-10-5-3-2-4-6-10/h2-9H,1H3,(H2,16,17,18,19)
InChI Key HDDSHPAODJUKPD-UHFFFAOYSA-N
Canonical SMILES COC(=O)NC1=NC2=C(N1)C=C(C=C2)SC3=CC=CC=C3
CAS 43210679
Splash
Other Names 2-(Methoxycarbonylamino)-5-(phenylthio)benzimidazole;
Methyl [5-(phenylsulfanyl)-1H-benzimidazol-2-yl]carbamate;
2-Benzimidazolecarbamic acid, 5-(phenylthio)-, methyl ester;
[5-(Phenylthio)-1H-benzimidazol-2-yl]carbamic acid methyl ester;
Methyl [5-(phenylthio)-1H-benzimidazol-2-yl]carbamate;
Carbamic acid, [5-(phenylthio)-1H-benzimidazol-2-yl]-, methyl ester;
Methoxy-N-(5-phenylthiobenzimidazol-2-yl)carboxamide;
Methyl N-[5-(phenylsulfanyl)-1H-1,3-benzodiazol-2-yl]carbamate;
Panacur;
Phenbendasol

In Other Databases

PubChem 3334
ChEMBL CHEMBL37161
KEGG D04140
ChemSpider 3217
Wikipedia Fenbendazole
ChemIDPlus 043210679
HMDb HMDB29745
ChEBI CHEBI:77092