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CHEBI:77054 - N-{5-chloro-4-[(4-chlorophenyl)(cyano)methyl]-2-methylphenyl}-2-hydroxy-3,5-diiodobenzamide

Default Structure
ChEBI IDCHEBI:77054
ChEBI NameN-{5-chloro-4-[(4-chlorophenyl)(cyano)methyl]-2-methylphenyl}-2-hydroxy-3,5-diiodobenzamide
Stars
ASCII NameN-{5-chloro-4-[(4-chlorophenyl)(cyano)methyl]-2-methylphenyl}-2-hydroxy-3,5-diiodobenzamide
DefinitionAn aromatic amide resulting from the formal condensation of the carboxy group of 3,5-diiodosalicylic acid with the amino group of aniline substituted at positions 2, 4, and 5 by methyl, (4-chlorophenyl)(cyano)methyl, and methyl groups respectively.
Last Modified25 February 2016
SubmitterGareth Owen
DownloadsMolfile
FormulaC22H14Cl2I2N2O2
Net Charge0
Average Mass663.080
Monoisotopic Mass661.85218
SMILESCc1cc(C(C#N)c2ccc(Cl)cc2)c(Cl)cc1NC(=O)c1cc(I)cc(I)c1O
InChIInChI=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)
InChIKeyJMPFSEBWVLAJKM-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
N-{5-chloro-4-[(4-chlorophenyl)(cyano)methyl]-2-methylphenyl}-2-hydroxy-3,5-diiodobenzamide (CHEBI:77054) is a aromatic amide (CHEBI:62733)
N-{5-chloro-4-[(4-chlorophenyl)(cyano)methyl]-2-methylphenyl}-2-hydroxy-3,5-diiodobenzamide (CHEBI:77054) is a monocarboxylic acid amide (CHEBI:29347)
N-{5-chloro-4-[(4-chlorophenyl)(cyano)methyl]-2-methylphenyl}-2-hydroxy-3,5-diiodobenzamide (CHEBI:77054) is a monochlorobenzenes (CHEBI:83403)
N-{5-chloro-4-[(4-chlorophenyl)(cyano)methyl]-2-methylphenyl}-2-hydroxy-3,5-diiodobenzamide (CHEBI:77054) is a nitrile (CHEBI:18379)
N-{5-chloro-4-[(4-chlorophenyl)(cyano)methyl]-2-methylphenyl}-2-hydroxy-3,5-diiodobenzamide (CHEBI:77054) is a organoiodine compound (CHEBI:37142)
N-{5-chloro-4-[(4-chlorophenyl)(cyano)methyl]-2-methylphenyl}-2-hydroxy-3,5-diiodobenzamide (CHEBI:77054) is a phenols (CHEBI:33853)
Incoming Relation(s)
(R)-closantel (CHEBI:77056) is a N-{5-chloro-4-[(4-chlorophenyl)(cyano)methyl]-2-methylphenyl}-2-hydroxy-3,5-diiodobenzamide (CHEBI:77054)
(S)-closantel (CHEBI:77057) is a N-{5-chloro-4-[(4-chlorophenyl)(cyano)methyl]-2-methylphenyl}-2-hydroxy-3,5-diiodobenzamide (CHEBI:77054)
IUPAC Name 
N-{5-chloro-4-[(4-chlorophenyl)(cyano)methyl]-2-methylphenyl}-2-hydroxy-3,5-diiodobenzamide
Manual XrefsDatabases
1809VSDB
LSM-4989LINCS