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CHEBI:83758 - 1-{[3-(2-chlorophenyl)-2-(4-fluorophenyl)oxiran-2-yl]methyl}-1H-1,2,4-triazole

ChEBI IDCHEBI:83758
ChEBI Name1-{[3-(2-chlorophenyl)-2-(4-fluorophenyl)oxiran-2-yl]methyl}-1H-1,2,4-triazole
Stars
ASCII Name1-{[3-(2-chlorophenyl)-2-(4-fluorophenyl)oxiran-2-yl]methyl}-1H-1,2,4-triazole
DefinitionAn epoxide that is oxirane substituted by a 2-chlorophenyl, 4-fluorophenyl and a 1H-1,2,4-triazol-1-ylmethyl groups.
Last Modified14 November 2014
Submitternamrata
DownloadsMolfile
FormulaC17H13ClFN3O
Net Charge0
Average Mass329.762
Monoisotopic Mass329.07312
SMILES[H]C1(c2ccccc2Cl)OC1(Cn1cncn1)c1ccc(F)cc1
InChIInChI=1S/C17H13ClFN3O/c18-15-4-2-1-3-14(15)16-17(23-16,9-22-11-20-10-21-22)12-5-7-13(19)8-6-12/h1-8,10-11,16H,9H2
InChIKeyZMYFCFLJBGAQRS-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
1-{[3-(2-chlorophenyl)-2-(4-fluorophenyl)oxiran-2-yl]methyl}-1H-1,2,4-triazole (CHEBI:83758) is a epoxide (CHEBI:32955)
1-{[3-(2-chlorophenyl)-2-(4-fluorophenyl)oxiran-2-yl]methyl}-1H-1,2,4-triazole (CHEBI:83758) is a monochlorobenzenes (CHEBI:83403)
1-{[3-(2-chlorophenyl)-2-(4-fluorophenyl)oxiran-2-yl]methyl}-1H-1,2,4-triazole (CHEBI:83758) is a monofluorobenzenes (CHEBI:83575)
1-{[3-(2-chlorophenyl)-2-(4-fluorophenyl)oxiran-2-yl]methyl}-1H-1,2,4-triazole (CHEBI:83758) is a triazoles (CHEBI:35727)
Incoming Relation(s)
(2R,3S)-epoxiconazole (CHEBI:83761) is a 1-{[3-(2-chlorophenyl)-2-(4-fluorophenyl)oxiran-2-yl]methyl}-1H-1,2,4-triazole (CHEBI:83758)
(2S,3R)-epoxiconazole (CHEBI:83759) is a 1-{[3-(2-chlorophenyl)-2-(4-fluorophenyl)oxiran-2-yl]methyl}-1H-1,2,4-triazole (CHEBI:83758)
IUPAC Name 
1-{[3-(2-chlorophenyl)-2-(4-fluorophenyl)oxiran-2-yl]methyl}-1H-1,2,4-triazole