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N-[2-(3,4-diethoxyphenyl)ethyl]-2-[1-(4-iodophenyl)tetrazol-5-yl]sulfanyl-acetamide
SpectraBase Compound ID FV7xslss1P9
InChI InChI=1S/C21H24IN5O3S/c1-3-29-18-10-5-15(13-19(18)30-4-2)11-12-23-20(28)14-31-21-24-25-26-27(21)17-8-6-16(22)7-9-17/h5-10,13H,3-4,11-12,14H2,1-2H3,(H,23,28)
InChIKey NMSJTLZMEJYNTJ-UHFFFAOYSA-N
Mol Weight 553.42 g/mol
Molecular Formula C21H24IN5O3S
Exact Mass 553.064456 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5UiDhdD7RCZ
Name N-[2-(3,4-diethoxyphenyl)ethyl]-2-[1-(4-iodophenyl)tetrazol-5-yl]sulfanyl-acetamide
Alternate Name(s) N-[2-(3,4-diethoxyphenyl)ethyl]-2-[[1-(4-iodophenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]ethanamide N-[2-(3,4-diethoxyphenyl)ethyl]-2-[[1-(4-iodophenyl)-5-tetrazolyl]thio]acetamide N-[2-(3,4-diethoxyphenyl)ethyl]-2-[[1-(4-iodophenyl)tetrazol-5-yl]thio]acetamide
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Formula C21H24IN5O3S
InChI InChI=1S/C21H24IN5O3S/c1-3-29-18-10-5-15(13-19(18)30-4-2)11-12-23-20(28)14-31-21-24-25-26-27(21)17-8-6-16(22)7-9-17/h5-10,13H,3-4,11-12,14H2,1-2H3,(H,23,28)
InChIKey NMSJTLZMEJYNTJ-UHFFFAOYSA-N
Molecular Weight 553.419 g/mol
SMILES N(C(=O)CSc1nnn[n]1-c1ccc(I)cc1)CCc1ccc(c(c1)OCC)OCC
SPLASH splash10-0006-9810000000-a5e20bb7bf33b471b1ee
Wiley ID 1445732