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2-(acetyloxy)-4-{[(3-cyano-6-phenyl-2-pyridinyl)sulfanyl]acetyl}phenyl acetate
SpectraBase Compound ID Gysu7uqanBS
InChI InChI=1S/C24H18N2O5S/c1-15(27)30-22-11-9-18(12-23(22)31-16(2)28)21(29)14-32-24-19(13-25)8-10-20(26-24)17-6-4-3-5-7-17/h3-12H,14H2,1-2H3
InChIKey OKUNUWXDABSZNZ-UHFFFAOYSA-N
Mol Weight 446.48 g/mol
Molecular Formula C24H18N2O5S
Exact Mass 446.093643 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FasIIdIQa9Y
Name 2-(acetyloxy)-4-{[(3-cyano-6-phenyl-2-pyridinyl)sulfanyl]acetyl}phenyl acetate
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Formula C24H18N2O5S
InChI InChI=1S/C24H18N2O5S/c1-15(27)30-22-11-9-18(12-23(22)31-16(2)28)21(29)14-32-24-19(13-25)8-10-20(26-24)17-6-4-3-5-7-17/h3-12H,14H2,1-2H3
InChIKey OKUNUWXDABSZNZ-UHFFFAOYSA-N
Molecular Weight 446.477 g/mol
SMILES c1ccc(-c2nc(c(C#N)cc2)SCC(c2cc(OC(=O)C)c(cc2)OC(=O)C)=O)cc1
SPLASH splash10-004u-4920000000-43e270afb53b6e499609
Synonyms Acetic acid 2-acetoxy-5-[2-(3-cyano-6-phenyl-pyridin-2-ylsulfanyl)-acetyl]-phenyl ester Acetic acid[2-acetoxy-4-[2-[(3-cyano-6-phenyl-2-pyridyl)thio]acetyl]phenyl]ester Acetic acid[2-acetyloxy-4-[2-[(3-cyano-6-phenyl-2-pyridinyl)thio]-1-oxoethyl]phenyl]ester [2-acetoxy-4-[2-[(3-cyano-6-phenyl-2-pyridyl)sulfanyl]acetyl]phenyl]acetate [2-acetyloxy-4-[2-(3-cyano-6-phenyl-pyridin-2-yl)sulfanylethanoyl]phenyl]ethanoate [2-acetyloxy-4-[2-(3-cyano-6-phenylpyridin-2-yl)sulfanylacetyl]phenyl]acetate Acetic acid [2-acetyloxy-4-[2-[(3-cyano-6-phenyl-2-pyridinyl)thio]-1-oxoethyl]phenyl] ester [2-acetyloxy-4-[2-(3-cyano-6-phenylpyridin-2-yl)sulfanylacetyl]phenyl] acetate [2-acetoxy-4-[2-[(3-cyano-6-phenyl-2-pyridyl)sulfanyl]acetyl]phenyl] acetate [2-acetyloxy-4-[2-(3-cyano-6-phenyl-pyridin-2-yl)sulfanylethanoyl]phenyl] ethanoate
Wiley ID 1460663