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2-[3-(2,6-dichlorophenyl)-5-methyl-4-isoxazolyl]-5-(5-nitro-2-thienyl)-delta square-1,3,4-oxadiazolin-4-yl methyl ketone
SpectraBase Compound ID D9pJ8iZ2mUL
InChI InChI=1S/C18H12Cl2N4O5S/c1-8-14(16(22-29-8)15-10(19)4-3-5-11(15)20)17-21-23(9(2)25)18(28-17)12-6-7-13(30-12)24(26)27/h3-7,18H,1-2H3
InChIKey ORIAFMSIYORYAR-UHFFFAOYSA-N
Mol Weight 467.28 g/mol
Molecular Formula C18H12Cl2N4O5S
Exact Mass 465.990546 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DvKVDlgpibO
Name 1-[5-[3-(2,6-dichlorophenyl)-5-methyl-1,2-oxazol-4-yl]-2-(5-nitrothiophen-2-yl)-2H-1,3,4-oxadiazol-3-yl]ethanone
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Formula C18H12Cl2N4O5S
InChI InChI=1S/C18H12Cl2N4O5S/c1-8-14(16(22-29-8)15-10(19)4-3-5-11(15)20)17-21-23(9(2)25)18(28-17)12-6-7-13(30-12)24(26)27/h3-7,18H,1-2H3
InChIKey ORIAFMSIYORYAR-UHFFFAOYSA-N
Molecular Weight 467.283 g/mol
SMILES c1ccc(c(-c2c(C3=NN(C(O3)c3sc(N(=O)=O)cc3)C(=O)C)c(on2)C)c1Cl)Cl
SPLASH splash10-0006-9140000000-539fe56b93d4c2a1b196
Synonyms 1-[5-[3-(2,6-dichlorophenyl)-5-methyl-4-isoxazolyl]-2-(5-nitro-2-thiophenyl)-2H-1,3,4-oxadiazol-3-yl]ethanone 1-[5-[3-(2,6-dichlorophenyl)-5-methyl-isoxazol-4-yl]-2-(5-nitro-2-thienyl)-2H-1,3,4-oxadiazol-3-yl]ethanone 1-[5-[3-[2,6-bis(chloranyl)phenyl]-5-methyl-1,2-oxazol-4-yl]-2-(5-nitrothiophen-2-yl)-2H-1,3,4-oxadiazol-3-yl]ethanone
Wiley ID 1438308