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N-[6-tert-butyl-3-(phenethylcarbamoyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]furan-2-carboxamide
SpectraBase Compound ID NYiWKe0Ygy
InChI InChI=1S/C26H30N2O3S/c1-26(2,3)18-11-12-19-21(16-18)32-25(28-23(29)20-10-7-15-31-20)22(19)24(30)27-14-13-17-8-5-4-6-9-17/h4-10,15,18H,11-14,16H2,1-3H3,(H,27,30)(H,28,29)
InChIKey YXAJARSEPKUFKT-UHFFFAOYSA-N
Mol Weight 450.6 g/mol
Molecular Formula C26H30N2O3S
Exact Mass 450.197714 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EgpGa464qTK
Name N-[6-tert-butyl-3-(phenethylcarbamoyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]furan-2-carboxamide
Alternate Name(s) N-[6-tert-butyl-3-(phenethylcarbamoyl)-4,5,6,7-tetrahydrobenzothiophen-2-yl]-2-furamide N-[6-tert-butyl-3-[oxo-(2-phenylethylamino)methyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-furancarboxamide N-[6-tert-butyl-3-(2-phenylethylcarbamoyl)-4,5,6,7-tetrahydrobenzothiophen-2-yl]furan-2-carboxamide
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Formula C26H30N2O3S
InChI InChI=1S/C26H30N2O3S/c1-26(2,3)18-11-12-19-21(16-18)32-25(28-23(29)20-10-7-15-31-20)22(19)24(30)27-14-13-17-8-5-4-6-9-17/h4-10,15,18H,11-14,16H2,1-3H3,(H,27,30)(H,28,29)
InChIKey YXAJARSEPKUFKT-UHFFFAOYSA-N
Molecular Weight 450.597 g/mol
SMILES N(C(=O)c1ccco1)c1c(C(NCCc2ccccc2)=O)c2CCC(Cc2s1)C(C)(C)C
SPLASH splash10-0002-9432200000-bda4d0330186a2f2a7ff
Wiley ID 1461589