CHEBI:78621 - monepantel

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ChEBI Name monepantel
Definition A secondary carboxamide resulting from the formal condensation of the carboxy group of p-[(trifluoromethyl)sulfanyl]benzoic acid with the amino group of (2S)-2-amino-3-hydroxy-2-methylpropanenitrile in which the hydroxy group has been converted to the corresponding 5-cyano-2-(trifluoromethyl)phenyl ether. A broad-spectrum nematicide, it is used to control gastrointestinal roundworms in sheep and goats.
Stars This entity has been manually annotated by the ChEBI Team.
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Formula C20H13F6N3O2S
Net Charge 0
Average Mass 473.39200
Monoisotopic Mass 473.06327
InChI InChI=1S/C20H13F6N3O2S/c1-18(10-28,11-31-16-8-12(9-27)2-7-15(16)19(21,22)23)29-17(30)13-3-5-14(6-4-13)32-20(24,25)26/h2-8H,11H2,1H3,(H,29,30)/t18-/m0/s1
SMILES C[C@](COc1cc(ccc1C(F)(F)F)C#N)(NC(=O)c1ccc(SC(F)(F)F)cc1)C#N
Roles Classification
Application(s): anthelminthic drug
Substance intended to kill parasitic worms (helminths).
A substance used to destroy pests of the phylum Nematoda (roundworms).
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ChEBI Ontology
Outgoing monepantel (CHEBI:78621) has role anthelminthic drug (CHEBI:35443)
monepantel (CHEBI:78621) has role nematicide (CHEBI:25491)
monepantel (CHEBI:78621) is a (trifluoromethyl)benzenes (CHEBI:83565)
monepantel (CHEBI:78621) is a aromatic ether (CHEBI:35618)
monepantel (CHEBI:78621) is a aryl sulfide (CHEBI:35683)
monepantel (CHEBI:78621) is a nitrile (CHEBI:18379)
monepantel (CHEBI:78621) is a secondary carboxamide (CHEBI:140325)
INNs Sources
monepantel WHO MedNet
monepantel WHO MedNet
monépantel WHO MedNet
monepantelum WHO MedNet
Brand Name Source
Registry Numbers Types Sources
12337563 Reaxys Registry Number Reaxys
887148-69-8 CAS Registry Number ChemIDplus
Citations Waiting for Citations Types Sources
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Last Modified
07 March 2018