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2-Chloranyl-4,5-bis(fluoranyl)-N-[3-[(4-fluorophenyl)methylsulfanyl]-1,2,4-thiadiazol-5-yl]benzamide
SpectraBase Compound ID E1mGTpvtQHa
InChI InChI=1S/C16H9ClF3N3OS2/c17-11-6-13(20)12(19)5-10(11)14(24)21-15-22-16(23-26-15)25-7-8-1-3-9(18)4-2-8/h1-6H,7H2,(H,21,22,23,24)
InChIKey DDBNCUHXFHTVIT-UHFFFAOYSA-N
Mol Weight 415.84 g/mol
Molecular Formula C16H9ClF3N3OS2
Exact Mass 414.982766 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4HkCa2k2C9e
Name 2-Chloranyl-4,5-bis(fluoranyl)-N-[3-[(4-fluorophenyl)methylsulfanyl]-1,2,4-thiadiazol-5-yl]benzamide
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Formula C16H9ClF3N3OS2
InChI InChI=1S/C16H9ClF3N3OS2/c17-11-6-13(20)12(19)5-10(11)14(24)21-15-22-16(23-26-15)25-7-8-1-3-9(18)4-2-8/h1-6H,7H2,(H,21,22,23,24)
InChIKey DDBNCUHXFHTVIT-UHFFFAOYSA-N
Molecular Weight 415.836 g/mol
SMILES N(C(c1c(cc(c(c1)F)F)Cl)=O)c1nc(ns1)SCc1ccc(cc1)F
SPLASH splash10-0a4i-7910100000-8632a712335faabd5be3
Synonyms 2-Chloro-4,5-difluoro-N-[3-[(4-fluorobenzyl)thio]-1,2,4-thiadiazol-5-yl]benzamide 2-Chloro-4,5-difluoro-N-[3-[(4-fluorophenyl)methylsulfanyl]-1,2,4-thiadiazol-5-yl]benzamide 2-Chloro-4,5-difluoro-N-[3-[(4-fluorophenyl)methylthio]-1,2,4-thiadiazol-5-yl]benzamide
Wiley ID 1466320