CHEBI:77057 - (S)-closantel

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ChEBI Name (S)-closantel
ChEBI ID CHEBI:77057
ChEBI ASCII Name (S)-closantel
Definition An N-{5-chloro-4-[(4-chlorophenyl)(cyano)methyl]-2-methylphenyl}-2-hydroxy-3,5-diiodobenzamide that has S configuration.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C22H14Cl2I2N2O2
Net Charge 0
Average Mass 663.07400
Monoisotopic Mass 661.85217
InChI InChI=1S/C22H14Cl2I2N2O2/c1-11-6-15(17(10-27)12-2-4-13(23)5-3-12)18(24)9-20(11)28-22(30)16-7-14(25)8-19(26)21(16)29/h2-9,17,29H,1H3,(H,28,30)/t17-/m0/s1
InChIKey JMPFSEBWVLAJKM-KRWDZBQOSA-N
SMILES Cc1cc([C@@H](C#N)c2ccc(Cl)cc2)c(Cl)cc1NC(=O)c1cc(I)cc(I)c1O
ChEBI Ontology
Outgoing (S)-closantel (CHEBI:77057) is a N-{5-chloro-4-[(4-chlorophenyl)(cyano)methyl]-2-methylphenyl}-2-hydroxy-3,5-diiodobenzamide (CHEBI:77054)
Incoming closantel (CHEBI:77053) has part (S)-closantel (CHEBI:77057)
IUPAC Name
N-{5-chloro-4-[(S)-(4-chlorophenyl)(cyano)methyl]-2-methylphenyl}-2-hydroxy-3,5-diiodobenzamide
Last Modified
21 January 2014