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3,4,5-trimethoxy-N-[[6-(2-methylpropyl)-2-(methylthio)-3-pyridinyl]methyl]benzamide
SpectraBase Compound ID 3q6aBWKkCHU
InChI InChI=1S/C21H28N2O4S/c1-13(2)9-16-8-7-14(21(23-16)28-6)12-22-20(24)15-10-17(25-3)19(27-5)18(11-15)26-4/h7-8,10-11,13H,9,12H2,1-6H3,(H,22,24)
InChIKey CWEOOHVTARGFBM-UHFFFAOYSA-N
Mol Weight 404.53 g/mol
Molecular Formula C21H28N2O4S
Exact Mass 404.176979 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2O1nrorV3o
Name 3,4,5-trimethoxy-N-[[6-(2-methylpropyl)-2-(methylthio)-3-pyridinyl]methyl]benzamide
Alternate Name(s) 3,4,5-trimethoxy-N-[[6-(2-methylpropyl)-2-methylsulfanyl-pyridin-3-yl]methyl]benzamide N-[(6-isobutyl-2-methylsulfanyl-3-pyridyl)methyl]-3,4,5-trimethoxy-benzamide N-[[6-isobutyl-2-(methylthio)-3-pyridyl]methyl]-3,4,5-trimethoxy-benzamide
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Formula C21H28N2O4S
InChI InChI=1S/C21H28N2O4S/c1-13(2)9-16-8-7-14(21(23-16)28-6)12-22-20(24)15-10-17(25-3)19(27-5)18(11-15)26-4/h7-8,10-11,13H,9,12H2,1-6H3,(H,22,24)
InChIKey CWEOOHVTARGFBM-UHFFFAOYSA-N
Molecular Weight 404.525 g/mol
SMILES N(C(c1cc(OC)c(c(c1)OC)OC)=O)Cc1c(nc(CC(C)C)cc1)SC
SPLASH splash10-0a4j-5931000000-cd7acd741b63a1fe48ef
Wiley ID 1464464